Dolutegravir

Dolutegravir

SCHEMBL82071

C[C@@H]1CCO[C@H]2Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c(O)c3C(=O)N12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

pol

The experimentally established mechanism targets of Dolutegravir. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 18/20 1.00
CYP3A4 P08684 1/20 1.00
TMEM97 Q5BJF2 1/20 1.00
ABCG2 Q9UNQ0 1/20 1.00

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Dolutegravir SCHEMBL16478545 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL29474777 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL12264130 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL19929649 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL16440360 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL16440366 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL80619 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL29357473 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL10346729 1.00 SLC22A2 (1.00) SLC22A2CYP3A4TMEM97ABCG2
Dolutegravir SCHEMBL1835959 0.99 SLC22A2 (0.98) SLC22A2CYP3A4TMEM97ABCG2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 390 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12611453-B2 Method of inducing an HIV-1-specific immune response using a chimpanzee adenovirus vector encoding an hivacat t-cell immunogen and TLR7 agonist GILEAD SCIENCES, INC. (US) 2026-04-28 US claimed
US-12227518-B2 Crystalline polymorphs of sodium (4R,12AS)-9-{[(2,4-difluorophenyl) methyl]carbamoyl}-4-methyl-6,8-dioxo-3,4,6,8,12,12A-hexahydro-2H-pyrido [1′,2′:4,5]pyrazino[2,1-b][1,3]oxazin-7-olate and process for preparation thereof MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2025-02-18 US claimed
US-20240285645-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2024-08-29 US claimed
WO-2023091964-A2 COMPOSITIONS AND METHODS FOR THE INHIBITION OF TUMOR METASTASIS AND HORIZONTAL GENE TRANSFER THE REGENTS OF THE UNIVERSITY OF COLORADO A BODY CORPORATE (US) 2023-05-25 WO claimed
EP-4140485-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV Gilead Sciences, Inc. (US) 2023-03-01 EP claimed
EP-3045206-B2 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY VIIV HEALTHCARE CO (US) 2023-02-15 EP claimed
EP-3166607-B1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES INC (US) 2022-08-31 EP claimed
US-20220218711-A1 COMBINATION OF A TLR7 MODULATING COMPOUND AND AN HIV VACCINE GILEAD SCIENCES, INC. 2022-07-14 US claimed
EP-3972640-A1 COMBINATION OF A TLR7 MODULATING COMPOUND AND AN HIV VACCINE GILEAD SCIENCES, INC. (US) 2022-03-30 EP claimed
US-20220062293-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2022-03-03 US claimed
US-20170224695-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2017-08-10 US claimed
US-20170224694-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2017-08-10 US claimed
US-20170209454-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2017-07-27 US claimed
EP-3187226-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY VIIV Healthcare Company (US) 2017-07-05 EP claimed
US-8129385-B2 Substituted 5-hydroxy-3,4,6,9,9a, 10-hexanhydro-2h-1-oxa04a,8a-diaza-anthracene-6,10-dioness SHIONOGI & CO., LTD. (JP) 2012-03-06 US claimed
CN-122055373-A Bridged tricyclic carbamoyl pyridone compounds and uses thereof 吉利德科学公司 2026-05-15 CN disclosed
CN-122055369-A Bridged tricyclic carbamoyl pyridone compounds and uses thereof 吉利德科学公司 2026-05-15 CN disclosed
WO-2010011812-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-01-28 WO disclosed
WO-2010011819-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-01-28 WO disclosed
US-20090318421-A1 Polycyclic carbamoylpyridone derivative having hiv integrase inhibitory activity VIIV HEALTHCARE COMPANY 2009-12-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170209454-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY NR4A1, NCOA4, NR4A2 SLC22A2 2974/4885CYP3A4 28/4885TMEM97 3548/4885
US-12611453-B2 Method of inducing an HIV-1-specific immune response using a chimpanzee adenovirus vector encoding an hivacat t-cell immunogen and TLR7 agonist IRF3, STING1, MAVS SLC22A2 3484/4885CYP3A4 3581/4885TMEM97 2497/4885
US-20170224694-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY NR4A1, NCOA4, NR4A2 SLC22A2 2974/4885CYP3A4 28/4885TMEM97 3548/4885
US-20220218711-A1 COMBINATION OF A TLR7 MODULATING COMPOUND AND AN HIV VACCINE TLR7, TLR3, TLR9 SLC22A2 4131/4885CYP3A4 3239/4885TMEM97 2081/4885
US-20220062293-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV TLR7, TLR3, TLR6 SLC22A2 1927/4885CYP3A4 2399/4885TMEM97 122/4885
US-12227518-B2 Crystalline polymorphs of sodium (4R,12AS)-9-{[(2,4-difluorophenyl) methyl]carbamoyl}-4-methyl-6,8-dioxo-3,4,6,8,12,12A-hexahydro-2H-pyrido [1′,2′:4,5]pyrazino[2,1-b][1,3]oxazin-7-olate and process for preparation thereof CYP4A11, CYP4B1, CYP4F11 SLC22A2 1302/4885CYP3A4 22/4885TMEM97 3336/4885
US-20240285645-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV TLR7, TLR3, TLR6 SLC22A2 1927/4885CYP3A4 2399/4885TMEM97 122/4885
US-20170224695-A1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY NCOA4, NR4A1, NR4A2 SLC22A2 3012/4885CYP3A4 26/4885TMEM97 3407/4885
US-20090318421-A1 Polycyclic carbamoylpyridone derivative having hiv integrase inhibitory activity NR4A1, NCOA4, NR4A2 SLC22A2 2976/4885CYP3A4 28/4885TMEM97 3567/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.