SCHEMBL31236971

SCHEMBL31236971

COc1cc2c(cc1-c1cncc(C(N)=O)c1)-c1c(c(C(=O)N(C)C(C)(C)C)nn1-c1cc(Cl)cc(Cl)c1)CCO2

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 1/20 0.31
▸ MKNK2 Q9HBH9 1/20 0.31
▸ ALPL P05186 1/20 0.31
▸ CCNA2 P20248 2/20 0.30
▸ CDK2 P24941 2/20 0.30
▸ CCNA1 P78396 2/20 0.30
▸ TGFBR1 P36897 1/20 0.30
▸ ACVR1 Q04771 1/20 0.30

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
SCHEMBL19321678 0.93 NR1H4 (0.35) MKNK1MKNK2ALPLCCNA2CDK2
SCHEMBL17382238 0.89 NR1H4 (0.34) MKNK1MKNK2ALPL
SCHEMBL17381637 0.89 NR1H4 (0.35) MKNK1MKNK2ALPLCCNA2CDK2
SCHEMBL30681687 0.89 NR1H4 (0.34) CCNA2CDK2CCNA1
SCHEMBL20731110 0.89 NR1H4 (0.34) CCNA2CDK2CCNA1
SCHEMBL31236967 0.88 ABL1 (0.33) TGFBR1ACVR1
SCHEMBL30759625 0.88 PDE7A (0.36) MKNK1MKNK2ALPLCCNA2CDK2
SCHEMBL27119776 0.88 PDE7A (0.36) MKNK1MKNK2ALPLCCNA2CDK2
SCHEMBL30759608 0.87 PDE7A (0.35) MKNK1MKNK2ALPLCCNA2CDK2
SCHEMBL27118994 0.87 PDE7A (0.35) MKNK1MKNK2ALPLCCNA2CDK2

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-2024263803-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-12-26 — — WO disclosed
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