SCHEMBL28837384

SCHEMBL28837384

NCc1ccccc1C(C=O)Cc1cccc(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.46
DRD2 P14416 1/20 0.41
DRD1 P21728 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
GRIA2 P42262 1/20 0.38
SLC6A5 Q9Y345 1/20 0.37
CHRNA1 P02708 2/20 0.36
CHRNG P07510 2/20 0.36
CHRNB1 P11230 2/20 0.36
CHRND Q07001 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
MAPK1 P28482 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
ANPEP P15144 1/20 0.36

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
SCHEMBL28837424 0.83 ENPP2 (0.40) ENPP2DRD2DRD1TAAR1GRIA2
SCHEMBL28837383 0.81 ENPP2 (0.49) ENPP2DRD2DRD1TAAR1GRIA2
SCHEMBL28116860 0.75 ENPP2 (0.43) ENPP2DRD2DRD1TAAR1GRIA2
SCHEMBL27656978 0.71 PNMT (0.35) KDM4EOPRK1
SCHEMBL19609050 0.70 ENPP2 (0.47) ENPP2DRD2DRD1TAAR1GRIA2
SCHEMBL27882555 0.69 MPO (0.47) KMT2AKDM4ELMNAMAPTOPRK1
SCHEMBL26999351 0.68 POLB (0.44) TAAR1CYP1A2PKMMAPK1ANPEP
SCHEMBL7197326 0.67 CAPN1 (0.44) CYP1A2PKMALOX15KMT2AMAPT
Phenol SCHEMBL28177861 0.67 POLB (0.43) TAAR1MAPK1SLC6A2SLC6A4SLC6A3
SCHEMBL138953 0.66

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
CN-106547168-A A kind of black-matrix material compositionss and application 深圳市华星光电技术有限公司 2017-03-29 CN disclosed