SCHEMBL30684918

SCHEMBL30684918

Cc1ccc(-n2ccc3cnc(N)nc32)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 1/20 0.57
▸ MAP3K14 Q99558 16/20 0.49
▸ PTK2 Q05397 1/20 0.49
▸ DHFR P00374 1/20 0.46
▸ ROCK1 Q13464 1/20 0.41

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
SCHEMBL28986246 0.84 MAPKAPK2 (0.57) MAPKAPK2MAP3K14ROCK1
SCHEMBL26270373 0.83 MAPKAPK2 (0.56) MAPKAPK2MAP3K14DHFRROCK1
SCHEMBL28986278 0.80 MAPKAPK2 (0.56) MAPKAPK2MAP3K14
SCHEMBL30219552 0.80 MAPKAPK2 (0.56) MAPKAPK2MAP3K14
SCHEMBL23110509 0.78 PTK2 (0.59) PTK2ROCK1
SCHEMBL4978113 0.76 XDH (0.48) DHFR
SCHEMBL28986210 0.74 MAPKAPK2 (0.53) MAPKAPK2MAP3K14
SCHEMBL30219596 0.74 MAPKAPK2 (0.53) MAPKAPK2MAP3K14PTK2
SCHEMBL28986263 0.74 MAPKAPK2 (0.56) MAPKAPK2MAP3K14
SCHEMBL30219632 0.74 MAPKAPK2 (0.56) MAPKAPK2MAP3K14

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-117263940-A FGFR inhibitor, preparation method thereof, pharmaceutical composition and application 中国药科大学 2023-12-22 — — CN claimed
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