SCHEMBL4479511

SCHEMBL4479511

CN(C)C(=O)c1c2c(c(O)c(=O)n1C)C(=O)N(Cc1ccc(F)c(Cl)c1)CC2

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.36
CENPE Q02224 2/20 0.35
FSCN1 Q16658 1/20 0.34
MAPK1 P28482 1/20 0.34
WDR5 P61964 1/20 0.33
PIK3CB P42338 1/20 0.33
HTR2A P28223 1/20 0.33
GRM2 Q14416 1/20 0.33
PIK3CA P42336 1/20 0.33
KCNH2 Q12809 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
MAOB P27338 1/20 0.33
TNIK Q9UKE5 1/20 0.32

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
SCHEMBL31060990 1.00 AKR1B1 (0.36) AKR1B1CENPEFSCN1MAPK1WDR5
SCHEMBL4488414 0.99 AKR1B1 (0.35) AKR1B1CENPEFSCN1MAPK1WDR5
SCHEMBL6032525 0.93 AKR1B1 (0.32) AKR1B1CENPEFSCN1MAPK1WDR5
SCHEMBL4501621 0.92 CENPE (0.39) AKR1B1CENPEFSCN1MAPK1WDR5
SCHEMBL4480852 0.92 CENPE (0.36) AKR1B1CENPEFSCN1WDR5HTR2A
SCHEMBL5437380 0.92 CENPE (0.38) CENPEKCNH2MAOB
SCHEMBL5437421 0.92 AKR1B1 (0.36) AKR1B1MAPK1KCNH2HRH3
SCHEMBL4496915 0.91 AKR1B1 (0.34) AKR1B1CENPEFSCN1MAPK1WDR5
SCHEMBL4489034 0.91 AKR1B1 (0.38) AKR1B1MAPK1HTR2AGRM2PIK3CA
SCHEMBL5446606 0.91 WDR5 (0.36) CENPEWDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7598264-B2 HIV integrase inhibitors MERCK & CO., INC. (US) 2009-10-06 US claimed
US-20070179196-A1 Hiv integrase inhibitors MERCK SHARP & DOHME CORP. 2007-08-02 US claimed
EP-1725556-A1 HIV INTEGRASE INHIBITORS Merck & Co., Inc. (US) 2006-11-29 EP claimed
WO-2005087768-A1 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2005-09-22 WO claimed
WO-2005087767-A1 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2005-09-22 WO claimed
CN-122055369-A Bridged tricyclic carbamoyl pyridone compounds and uses thereof 吉利德科学公司 2026-05-15 CN disclosed
CN-122055373-A Bridged tricyclic carbamoyl pyridone compounds and uses thereof 吉利德科学公司 2026-05-15 CN disclosed
CN-122005785-A Method for identifying HIV patients susceptible to therapy with GP 120V 3 glycan-directed antibodies 吉利德科学公司 2026-05-12 CN disclosed
WO-2026090160-A2 CD4-TARGETED IL-15 MOLECULES AND METHODS OF USE GILEAD SCIENCES, INC. (US) 2026-04-30 WO disclosed
US-20260109746-A1 CD4-TARGETED IL-15 MOLECULES AND METHODS OF USE GILEAD SCIENCES INC (US) 2026-04-23 US disclosed
EP-4719608-A1 QUINAZOLINYL-INDAZOLE DERIVATIVES AS THERAPEUTIC COMPOUNDS FOR HIV GILEAD SCIENCES, INC. (US) 2026-04-08 EP disclosed
EP-4720056-A1 SOLID FORMS OF COMPOUNDS USEFUL IN THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2026-04-08 EP disclosed
US-7598264-B2 HIV integrase inhibitors MERCK & CO., INC. (US) 2009-10-06 US disclosed
US-20070179196-A1 Hiv integrase inhibitors MERCK SHARP & DOHME CORP. 2007-08-02 US disclosed
US-20070179196-A1 Hiv integrase inhibitors MERCK SHARP & DOHME CORP. 2007-08-02 US disclosed
US-20070179196-A1 Hiv integrase inhibitors MERCK SHARP & DOHME CORP. 2007-08-02 US disclosed
EP-1725556-A1 HIV INTEGRASE INHIBITORS Merck & Co., Inc. (US) 2006-11-29 EP disclosed
WO-2006060731-A2 USE OF ATAZANAVIR FOR IMPROVING THE PHARMACOKINETICS OF DRUGS METABOLIZED BY UGT1A1 MERCK & CO., INC. (US) 2006-06-08 WO disclosed
WO-2005087768-A1 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2005-09-22 WO disclosed
WO-2005087767-A1 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2005-09-22 WO 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 (2 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-20070179196-A1 Hiv integrase inhibitors REV1, TYMP, POLR2H AKR1B1 2248/4885CENPE 3362/4885FSCN1 4613/4885
US-20260109746-A1 CD4-TARGETED IL-15 MOLECULES AND METHODS OF USE IL15, IL15RA, CD4 AKR1B1 3473/4885CENPE 2464/4885FSCN1 2241/4885

“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.