SCHEMBL10367170

SCHEMBL10367170

COc1ccc(C2CC(N)C(O)c3ccccc3O2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.48
MAPT P10636 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM1A O60341 2/20 0.44
MAOA P21397 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP19A1 P11511 3/20 0.41
CYP3A4 P08684 1/20 0.40
ABCB1 P08183 1/20 0.39
AR P10275 1/20 0.39
ABCG2 Q9UNQ0 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
SCHEMBL10574481 0.85 MAOB (0.45) MAOBMAPTCYP19A1CYP3A4
SCHEMBL10365192 0.85 ABCG2 (0.51) MAOBMAPTMEN1KMT2ATDP1
SCHEMBL10367118 0.85 CYP19A1 (0.58) MAOBMAPTMEN1KMT2ATDP1
SCHEMBL10366584 0.85 MAOB (0.41) MAOBMAPTKDM1AMAOAKDM4E
SCHEMBL10366995 0.83 MEN1 (0.44) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL9379992 0.83 CYP19A1 (0.36) MAOBMEN1KMT2AKDM4ECYP19A1
SCHEMBL10365621 0.83 RET (0.42) MAOBAR
SCHEMBL10367171 0.82 HTR2C (0.43) KDM4ECYP19A1CYP3A4
SCHEMBL10574485 0.77 TAAR1 (0.40) MAOBKDM1AMAOAAR
SCHEMBL10365195 0.76 KDM4E (0.46) MEN1KMT2ATDP1KDM4ECYP19A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0250265-B1 2-PHENYLBENZOXEPIN DERIVATIVE SUNTORY LIMITED (JP) 1990-09-05 EP disclosed
US-4845094-A HYPOGLYCEMIC, ANTICOAGULANT SUNTORY LIMITED (JP) 1989-07-04 US disclosed
EP-0250265-A1 2-Phenylbenzoxepin derivative SUNTORY LIMITED (JP) 1987-12-23 EP disclosed