SCHEMBL31533117

SCHEMBL31533117

Oc1cc(OCc2ccc(Cl)cc2)ccc1-c1nccc(C(F)(F)F)n1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.45
▸ MAOA P21397 6/20 0.45
▸ AR P10275 1/20 0.42
▸ NR4A2 P43354 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ DHFR P00374 1/20 0.41
▸ ALOX5AP P20292 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ APP P05067 1/20 0.39

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
SCHEMBL19319839 0.79 LMNA (0.43) MAOBMAOAARLMNASMN1; SMN2
SCHEMBL19319841 0.79 MAPT (0.49) MAOBMAOALMNASMN1; SMN2NPSR1
SCHEMBL31533155 0.79 MAOB (0.39) MAOBMAOAARSMN1; SMN2DHFR
SCHEMBL31533098 0.79 NPSR1 (0.52) MAOBMAOAARLMNASMN1; SMN2
SCHEMBL31533094 0.78 MAOB (0.44) MAOBMAOAARNR4A2LMNA
SCHEMBL31533147 0.78 MAOB (0.46) MAOBMAOAARNR4A2LMNA
SCHEMBL31533109 0.78 MAOB (0.46) MAOBMAOAARNR4A2LMNA
SCHEMBL19325027 0.78 MAOB (0.46) MAOBMAOAARNR4A2LMNA
SCHEMBL19319846 0.77 KDM4E (0.53) MAOBMAOAARLMNASMN1; SMN2
SCHEMBL19319838 0.77 POLB (0.46) MAOBNR4A2LMNASMN1; SMN2DHFR

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-119569635-A Biaryl ring inhibitors targeting c-Myc proteins 上海深势唯思科技有限责任公司 2025-03-07 — — CN disclosed
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