SCHEMBL29796580

SCHEMBL29796580

CNCCn1cc(-c2cnc3ccc(-c4nc[nH]c4-c4cccc(C)n4)cc3c2)cn1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 16/20 0.41
▸ MAPK14 Q16539 7/20 0.38
▸ KDR P35968 2/20 0.38
▸ FGFR1 P11362 1/20 0.38
▸ FGFR3 P22607 1/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ MET P08581 3/20 0.37
▸ PDE3B Q13370 1/20 0.37
▸ PDE3A Q14432 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ PDGFRA P16234 1/20 0.36
▸ FLT1 P17948 1/20 0.36
▸ FLT4 P35916 1/20 0.36
▸ PRKD1 Q15139 1/20 0.36

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
SCHEMBL23389590 1.00 TGFBR1 (0.41) TGFBR1MAPK14KDRFGFR1FGFR3
SCHEMBL25084865 0.91 FGFR1 (0.41) TGFBR1KDRFGFR1FGFR3FLT3
SCHEMBL30156408 0.91 FGFR1 (0.41) TGFBR1KDRFGFR1FGFR3FLT3
SCHEMBL23392175 0.90 TGFBR1 (0.45) TGFBR1MAPK14KDRFGFR1FGFR3
SCHEMBL25085211 0.88 TGFBR1 (0.40) TGFBR1MAPK14KDRMETCYP1A2
SCHEMBL29796379 0.88 TGFBR1 (0.42) TGFBR1MAPK14KDRFGFR1FGFR3
SCHEMBL23389789 0.88 TGFBR1 (0.42) TGFBR1MAPK14KDRFGFR1FGFR3
SCHEMBL23391921 0.87 TGFBR1 (0.42) TGFBR1MAPK14KDRCYP1A2PDGFRA
SCHEMBL30156049 0.86 MET (0.40) TGFBR1MAPK14KDRFGFR1FGFR3
SCHEMBL22075156 0.84 MET (0.46) TGFBR1MAPK14KDRFGFR1FGFR3

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 1504/4885KDR 86/4885

“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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