SCHEMBL8611039

SCHEMBL8611039

C(=Cc1ccc(N(c2ccccc2)N(c2ccccc2)c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 3/20 0.64
MAOB P27338 3/20 0.52
NFE2L2 Q16236 2/20 0.52
CYP19A1 P11511 2/20 0.52
MAOA P21397 2/20 0.52
TRPA1 O75762 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CTDSP1 Q9GZU7 1/20 0.43
S1PR4 O95977 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HSP90AA1 P07900 1/20 0.43
HPGD P15428 1/20 0.43
S1PR1 P21453 1/20 0.43
MAPK1 P28482 1/20 0.43
CCR6 P51684 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 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
SCHEMBL9971916 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL133152 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL14005735 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL243731 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL243730 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL10128952 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL13136849 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL13720653 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL13720595 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA
SCHEMBL5338475 0.85 RELA (0.64) RELAMAOBNFE2L2CYP19A1MAOA

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-0805823-A4 VAPOR PHASE SYNTHESIS OF RUBBERY POLYMERS GOODYEAR TIRE & RUBBER (US) 1998-05-06 EP disclosed
EP-0805823-A1 VAPOR PHASE SYNTHESIS OF RUBBERY POLYMERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1997-11-12 EP disclosed
WO-1997008211-A1 VAPOR PHASE SYNTHESIS OF RUBBERY POLYMERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1997-03-06 WO disclosed