SCHEMBL29796367

SCHEMBL29796367

Cc1cccc(-c2nc3ccccn3c2-c2ccc3ncc(-c4cn[nH]c4)cc3n2)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 17/20 0.41
▸ MAPK14 Q16539 2/20 0.35
▸ CDK4 P11802 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ AKT1 P31749 1/20 0.34
▸ AKT2 P31751 1/20 0.34
▸ FGFR1 P11362 1/20 0.34
▸ FGFR2 P21802 1/20 0.34
▸ FGFR3 P22607 1/20 0.34
▸ KDR P35968 1/20 0.34

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
SCHEMBL23389904 1.00 TGFBR1 (0.41) TGFBR1MAPK14CDK4CDK2AKT1
SCHEMBL25084975 0.88 TGFBR1 (0.42) TGFBR1MAPK14AKT1AKT2
SCHEMBL30156165 0.87 TGFBR1 (0.39) TGFBR1MAPK14CDK4CDK2AKT1
SCHEMBL25084498 0.87 TGFBR1 (0.39) TGFBR1MAPK14CDK4CDK2AKT1
SCHEMBL29796459 0.86 TGFBR1 (0.42) TGFBR1MAPK14CDK2AKT1AKT2
SCHEMBL23389972 0.86 TGFBR1 (0.42) TGFBR1MAPK14CDK2AKT1AKT2
SCHEMBL29796664 0.82 MAPT (0.39) TGFBR1CDK4CDK2
SCHEMBL23389872 0.82 MAPT (0.39) TGFBR1CDK4CDK2
SCHEMBL25084925 0.81 TGFBR1 (0.39) TGFBR1CDK4CDK2FGFR1FGFR2
SCHEMBL30156039 0.81 TGFBR1 (0.39) TGFBR1CDK4CDK2FGFR1FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11590116-B2 Substituted pyridines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-02-28 — — US disclosed
EP-4061809-A1 SUBSTITUTED 1,5-NAPHTHYRIDINES OR QUINOLINES AS ALK5 INHIBITORS Theravance Biopharma R&D IP, LLC (US) 2022-09-28 — — EP disclosed
CN-114728941-A Substituted 1, 5-naphthyridines or quinolines as ALK5 inhibitors 施万生物制药研发IP有限责任公司 2022-07-08 — — CN 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 (1 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-11590116-B2 Substituted pyridines and methods of use ALK, ACVR1, ACVR2A TGFBR1 211/4885MAPK14 1504/4885CDK4 1298/4885

“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.

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