SCHEMBL10364752

SCHEMBL10364752

NC1CC(c2ccccc2)Oc2cc(Cl)ccc2C1O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 8/20 0.39
AR P10275 2/20 0.38
MAP3K14 Q99558 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
FFAR1 O14842 2/20 0.35
DPP4 P27487 1/20 0.35
TRPM4 Q8TD43 1/20 0.34
TRPM5 Q9NZQ8 1/20 0.34
ATM Q13315 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL10365101 0.85 CYP19A1 (0.53) CYP19A1ARMEN1KMT2A
SCHEMBL10365621 0.84 RET (0.42) AR
SCHEMBL10366584 0.83 MAOB (0.41) CYP19A1AR
SCHEMBL10367118 0.81 CYP19A1 (0.58) CYP19A1ARMEN1KMT2ATDP1
SCHEMBL10365195 0.77 KDM4E (0.46) CYP19A1MEN1KMT2ATDP1DPP4
SCHEMBL10365193 0.76 FUCA1 (0.40) MEN1KMT2A
SCHEMBL10365725 0.74 GRIN2B (0.43) MEN1KMT2ASMN1; SMN2
SCHEMBL10365192 0.73 ABCG2 (0.51) CYP19A1ARMEN1KMT2ATDP1
SCHEMBL10574481 0.73 MAOB (0.45) CYP19A1
SCHEMBL9379992 0.73 CYP19A1 (0.36) CYP19A1ARMEN1KMT2A

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