SCHEMBL27348015

SCHEMBL27348015

NC(CCc1ccccc1)c1cccc(O)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 7/20 0.47
OPRD1 P41143 6/20 0.46
OPRM1 P35372 5/20 0.46
KYNU Q16719 1/20 0.45
ADRB1 P08588 1/20 0.45
MIF P14174 1/20 0.45
HTR2A P28223 1/20 0.45
ADRA1A P35348 1/20 0.45
HTR2B P41595 1/20 0.45
DRD2 P14416 2/20 0.44
DRD1 P21728 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
ANPEP P15144 3/20 0.44
ERAP1 Q9NZ08 3/20 0.44
ERAP2 Q6P179 2/20 0.44
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
DRD3 P35462 1/20 0.43
ENPP2 Q13822 1/20 0.43

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
SCHEMBL7710823 0.90 DRD2 (0.53) OPRK1OPRD1OPRM1DRD2DRD1
SCHEMBL20725551 0.88 ANPEP (0.46) HTR2ATAAR1ANPEPERAP1ERAP2
SCHEMBL499451 0.85 HIF1A (0.51) OPRK1OPRD1OPRM1KYNUADRB1
SCHEMBL7871790 0.85 HIF1A (0.51) OPRK1OPRD1OPRM1KYNUADRB1
SCHEMBL4748924 0.83 KYNU (0.47) KYNUADRB1MIFHTR2AADRA1A
SCHEMBL5924988 0.82 ANPEP (0.50) HTR2ATAAR1ANPEPERAP1ERAP2
SCHEMBL855071 0.82 ANPEP (0.50) HTR2ATAAR1ANPEPERAP1ERAP2
SCHEMBL8067078 0.82 ANPEP (0.50) HTR2ATAAR1ANPEPERAP1ERAP2
SCHEMBL20725527 0.81 LOXL2 (0.48) HTR2ATAAR1ANPEPERAP1ERAP2
SCHEMBL27549431 0.81 ADRA1A (0.51) OPRK1OPRM1ADRB1HTR2AADRA1A

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-1045780-A The preparation of new sulfonamide derivatives BOEHRINGER MANNHEIM GMBH (DE) 1990-10-03 CN disclosed