SCHEMBL38654153

SCHEMBL38654153

Cc1cccc(-c2nn(CC(=O)NCc3c(F)cncc3F)cc2-c2ccnc3ccccc23)n1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 20/20 0.63
▸ MAPK14 Q16539 6/20 0.63

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
SCHEMBL28822081 0.94 TGFBR1 (0.68) TGFBR1MAPK14
SCHEMBL28822066 0.89 TGFBR1 (0.64) TGFBR1MAPK14
SCHEMBL23409675 0.89 TGFBR1 (0.67) TGFBR1MAPK14
SCHEMBL29959983 0.89 TGFBR1 (0.67) TGFBR1MAPK14
SCHEMBL28822068 0.89 TGFBR1 (0.63) TGFBR1MAPK14
SCHEMBL23409876 0.88 TGFBR1 (0.68) TGFBR1MAPK14
SCHEMBL29959691 0.88 TGFBR1 (0.68) TGFBR1MAPK14
SCHEMBL23409678 0.86 TGFBR1 (0.64) TGFBR1MAPK14
SCHEMBL29959590 0.86 TGFBR1 (0.64) TGFBR1MAPK14
SCHEMBL23409676 0.85 TGFBR1 (0.63) TGFBR1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036718-A ALK5 inhibitor and preparation method and application thereof 安炎达医药技术(广州)有限公司 2026-05-15 — — CN disclosed
Send feedback