SCHEMBL29450593

SCHEMBL29450593

COC(=O)[C@H](CCSC)NC(=O)c1cccc2cc(NC[C@@H](N)CS)ccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 19/20 1.00
FNTB P49356 17/20 1.00
TDP1 Q9NUW8 3/20 0.71
PGGT1B P53609 7/20 0.59
KMT2A Q03164 1/20 0.49

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
SCHEMBL8750304 0.91 FNTA (1.00) FNTAFNTBTDP1PGGT1B
SCHEMBL14175665 0.86 FNTA (0.84) FNTAFNTBTDP1PGGT1BKMT2A
SCHEMBL8365606 0.83 FNTA (1.00) FNTAFNTBTDP1PGGT1B
SCHEMBL8586036 0.83 FNTA (1.00) FNTAFNTBTDP1PGGT1B
SCHEMBL6056511 0.83 FNTA (1.00) FNTAFNTBTDP1PGGT1B
SCHEMBL29381983 0.83 FNTA (1.00) FNTAFNTBTDP1PGGT1B
Hydrochloric Acid SCHEMBL8492799 0.82 FNTA (0.98) FNTAFNTBTDP1PGGT1B
Hydrochloric Acid SCHEMBL8492805 0.82 FNTA (0.98) FNTAFNTBTDP1PGGT1B
Hydrochloric Acid SCHEMBL29686212 0.82 FNTA (0.98) FNTAFNTBTDP1PGGT1B
SCHEMBL8495155 0.81 FNTA (0.69) FNTAFNTBTDP1PGGT1B

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658277-A1 METHODS OF TREATING VIRAL INFECTION Griffith University (AU) 2025-12-10 EP disclosed
US-20240285645-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2024-08-29 US disclosed
WO-2024159259-A1 METHODS OF TREATING VIRAL INFECTION GRIFFITH UNIVERSITY (AU) 2024-08-08 WO disclosed
EP-4140485-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV Gilead Sciences, Inc. (US) 2023-03-01 EP disclosed
EP-3166607-B1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES INC (US) 2022-08-31 EP disclosed
US-20220062293-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2022-03-03 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 (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-20220062293-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV TLR7, TLR3, TLR6 FNTA 3930/4885FNTB 2672/4885TDP1 2254/4885
US-20240285645-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV TLR7, TLR3, TLR6 FNTA 3930/4885FNTB 2672/4885TDP1 2254/4885

“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.