SCHEMBL14789410

SCHEMBL14789410

CCc1ccc(-n2cnc(C/C(=C/CCN)C(=O)O)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 11/20 0.40
▸ CPB1 P15086 6/20 0.40
▸ QPCT Q16769 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ WNT3A P56704 1/20 0.32
▸ NOTUM Q6P988 1/20 0.31
▸ PDE3B Q13370 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ ALDH1A1 P00352 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
SCHEMBL14789411 0.89 CPB2 (0.41) CPB2CPB1QPCTMAOBWNT3A
SCHEMBL14789403 0.87 CPB2 (0.51) CPB2CPB1PDE3BPDE3AALDH1A1
SCHEMBL14789459 0.86 MAP4K4 (0.41) CPB2CPB1QPCTKMT2ANOTUM
SCHEMBL14789425 0.86 CPB2 (0.41) CPB2CPB1QPCTPDE3BPDE3A
SCHEMBL14789483 0.86 CPB2 (0.41) CPB2CPB1
SCHEMBL14789624 0.86 CPB2 (0.56) CPB2CPB1MAOBALDH1A1
SCHEMBL14789635 0.85 CPB2 (0.45) CPB2CPB1MEN1KMT2AWNT3A
SCHEMBL14789437 0.83 CPB2 (0.44) CPB2CPB1MAOBNOTUM
SCHEMBL14790056 0.81 CPB2 (0.40) CPB2CPB1
SCHEMBL14789436 0.80 CPB1 (0.37) CPB2CPB1

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-2013039202-A1 NOVEL ACRYLIC ACID DERIVATIVE 第一三共株式会社 (JP) 2013-03-21 — — WO disclosed
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