SCHEMBL24251954

SCHEMBL24251954

Cc1cc(C2CCNC2)n2ncnc(N)c12

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACVRL1 P37023 11/20 0.62
▸ TYRO3 Q06418 4/20 0.38
▸ PIK3CD O00329 4/20 0.38
▸ MTOR P42345 1/20 0.36
▸ RICTOR Q6R327 1/20 0.36
▸ RPTOR Q8N122 1/20 0.36
▸ MAPKAP1 Q9BPZ7 1/20 0.36
▸ MLST8 Q9BVC4 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
SCHEMBL22132915 0.86 ACVRL1 (0.58) ACVRL1TYRO3PIK3CDMTORRICTOR
SCHEMBL27315078 0.82 ACVRL1 (0.47) ACVRL1PIK3CD
SCHEMBL19377690 0.78 ACVRL1 (0.61) ACVRL1TYRO3PIK3CDMTORRICTOR
SCHEMBL14488443 0.78 ACVRL1 (1.00) ACVRL1
Hydrochloric Acid SCHEMBL29720772 0.77 ACVRL1 (0.60) ACVRL1TYRO3PIK3CDMTORRICTOR
Hydrochloric Acid SCHEMBL19377754 0.77 ACVRL1 (0.60) ACVRL1TYRO3PIK3CDMTORRICTOR
SCHEMBL23337052 0.77 ACVRL1 (0.48) ACVRL1MTORRICTORRPTORMAPKAP1
SCHEMBL22132770 0.76 ACVRL1 (0.41) ACVRL1TYRO3PIK3CD
SCHEMBL16011145 0.75 ACVRL1 (1.00) ACVRL1
SCHEMBL22004981 0.75 PDE2A (0.50) —

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
WO-2022033532-A1 FGFR AND MUTATION INHIBITOR THEREOF, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海和誉生物医药科技有限公司 2022-02-17 — — WO disclosed
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