SCHEMBL8964203

SCHEMBL8964203

O=c1cc(C2=CCc3ccccc3O2)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
GAA P10253 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33
NOTUM Q6P988 1/20 0.33
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TSHR P16473 2/20 0.30
GLA P06280 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL667761 0.72 MAOA (0.45) MAOAMAOBGAAKDM4EALDH1A1
SCHEMBL29438383 0.72 MAOA (0.45) MAOAMAOBGAAKDM4EALDH1A1
SCHEMBL8657090 0.69 MAOA (0.36) MAOAMAOBALDH1A1CASP7L3MBTL1
SCHEMBL9087669 0.69 KDM4E (0.42) MAOAMAOBGAAKDM4EALDH1A1
SCHEMBL11391339 0.67 MAOA (0.48) MAOAMAOBGAANPC1LMNA
SCHEMBL276959 0.67 MAOA (0.48) MAOAMAOBGAANPC1LMNA
SCHEMBL10869264 0.67 MAOB (0.43) MAOAMAOBGAANPC1LMNA
SCHEMBL311687 0.67 MAOB (0.39) MAOAMAOBGAALMNARAB9A
SCHEMBL7868192 0.67 MAOA (0.39) MAOAMAOBGAANPSR1
SCHEMBL6622506 0.66 PTGS2 (0.47) KDM4EALDH1A1HPGDHSD17B10NPC1

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
US-5482942-A HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS AND MUSCULAR DISORDERS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-01-09 US disclosed