SCHEMBL9527650

SCHEMBL9527650

OC1c2ccccc2COc2cc(F)ccc21

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 5/20 0.49
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
MAPK14 Q16539 2/20 0.37
HTR1A P08908 4/20 0.36
PIN1 Q13526 1/20 0.36
NOTUM Q6P988 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ADRA2A P08913 1/20 0.35

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
SCHEMBL9530007 0.84 NR3C2 (0.44) NR3C2MAOBMAPK14HTR1APIN1
SCHEMBL16385859 0.83 NR3C2 (0.43) NR3C2MAPK14KDM4EALDH1A1GAA
SCHEMBL4465669 0.81 MAOA (0.59) MAOAMAOB
SCHEMBL7510366 0.81 MAOA (0.43) MAOAMAOBADRA2A
SCHEMBL10444469 0.79 NR3C2 (0.41) NR3C2MAPK14
SCHEMBL11732410 0.78 MAOA (0.68) NR3C2MAOAMAOBADRA2A
SCHEMBL21996315 0.75 MAOB (0.40) MAOAMAOBMAPK14ADRA2A
SCHEMBL10446532 0.74 HTR2C (0.40) NR3C2MAPK14NOTUMKDM4EALDH1A1
SCHEMBL10559305 0.74 DRD2 (0.42) NR3C2MAOBMAPK14NOTUM
SCHEMBL11281780 0.73 MAOB (0.46) MAOAMAOBMAPK14HTR1AADRA2A

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-0269755-B1 DIBENZ b,e]OXEPIN DERIVATIVE AND PHARMACEUTICAL CONTAINING THE SAME AS ACTIVE INGREDIENT DAINIPPON PHARMACEUTICAL CO (JP) 1993-11-18 EP disclosed
US-4889858-A ANTIHYPOXIC AGENTS, ANTICONVULSANTS, LIPID PEROXIDATION INHIBITORS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1989-12-26 US disclosed
EP-0269755-A1 DIBENZ b,e OXEPIN DERIVATIVE AND PHARMACEUTICAL CONTAINING THE SAME AS ACTIVE INGREDIENT Dainippon Pharmaceutical Co., Ltd. (JP) 1988-06-08 EP disclosed