SCHEMBL3979804

SCHEMBL3979804

NOCc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.67
IDO1 P14902 15/20 0.47
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45
HTR7 P34969 1/20 0.40
HTR2B P41595 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL456019 0.83 PNMT (0.62) PNMTDRD2DRD4DRD3HTR7
SCHEMBL7538016 0.83 PNMT (0.62) PNMTDRD2DRD4DRD3HTR7
SCHEMBL4989872 0.80 PNMT (1.00) PNMTDRD2DRD4DRD3HTR7
SCHEMBL1275883 0.80 PNMT (0.58) PNMTDRD2DRD4DRD3HTR7
SCHEMBL21359984 0.80 PNMT (0.58) PNMTDRD2DRD4DRD3NPC1
SCHEMBL425742 0.80 PNMT (0.58) PNMTDRD2DRD4DRD3HTR7
SCHEMBL29892750 0.80 PNMT (0.58) PNMTDRD2DRD4DRD3HTR7
SCHEMBL5366733 0.80 PNMT (0.72) PNMTDRD2DRD4DRD3HTR7
SCHEMBL7195192 0.80 PNMT (0.72) PNMTDRD2DRD4DRD3HTR7
SCHEMBL9610281 0.79 PNMT (0.57) PNMTDRD2DRD4DRD3HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116768784-A Organic semiconductor material containing fluorenylcarbazole amine electron donor, preparation method and application 浙江大学 2023-09-19 CN disclosed
EP-3189037-A1 QUINOLONES AS INHIBITORS OF CLASS IV BROMODOMAIN PROTEINS UCL Business PLC (GB) 2017-07-12 EP disclosed
WO-2016034512-A1 QUINOLONES AS INHIBITORS OF CLASS IV BROMODOMAIN PROTEINS UCL BUSINESS PLC (GB) 2016-03-10 WO disclosed
EP-2056801-A1 RUTHENIUM II COMPOUNDS The University Court of the University of Edinburgh (GB) 2009-05-13 EP disclosed
WO-2007135410-A1 RUTHENIUM II COMPOUNDS THE UNIVERSITY COURT OF THE UNVERSITY OF EDINBURGH (GB) 2007-11-29 WO disclosed