SCHEMBL6933733

SCHEMBL6933733

CC(C)c1cc(-c2ccccc2)ccc1-c1cc(N)ccc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.42
HSD17B10 Q99714 3/20 0.41
CYP3A4 P08684 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
TAAR1 Q96RJ0 2/20 0.41
ANPEP P15144 1/20 0.40
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 3/20 0.38
LMNA P02545 3/20 0.38
HTT P42858 3/20 0.38
KMT2A Q03164 3/20 0.38
HPGD P15428 2/20 0.38
ALOX12 P18054 2/20 0.38
PTPRC P08575 2/20 0.38

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
SCHEMBL1406552 0.80 ANPEP (0.46) MAOAHSD17B10CYP3A4TDP1ANPEP
SCHEMBL22554694 0.80 HSD17B10 (0.47) MAOAHSD17B10CYP3A4TDP1TAAR1
SCHEMBL9515040 0.80 HSD17B10 (0.47) MAOAHSD17B10CYP3A4TDP1TAAR1
SCHEMBL2833305 0.80 ALDH1A1 (0.47) MAOAHSD17B10CYP3A4TDP1TAAR1
SCHEMBL16105197 0.79 ANPEP (0.45) MAOAHSD17B10CYP3A4TDP1ANPEP
SCHEMBL27656417 0.79 ANPEP (0.44) MAOAHSD17B10CYP3A4TDP1TAAR1
SCHEMBL22589014 0.78 MEN1 (0.47) NPC1RAB9ASMN1; SMN2MEN1LMNA
SCHEMBL14744110 0.75 ANPEP (0.44) MAOAHSD17B10CYP3A4TDP1TAAR1
SCHEMBL5386210 0.75 ALDH1A1 (0.46) HSD17B10CYP3A4TDP1TAAR1ALDH1A1
SCHEMBL20851654 0.74 ALDH1A1 (0.56) MAOAHSD17B10CYP3A4TDP1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1186595-B1 Diaryl-p-phenylenediamine disulfides GOODYEAR TIRE & RUBBER (US) 2003-11-26 EP disclosed
US-6627686-B1 Mixture with rubber; oxidation resistance; tires, rolls, conveyor belts, footwear THE GOODYEAR TIRE & RUBBER COMPANY 2003-09-30 US disclosed
EP-1186595-A1 Diaryl-p-phenylenediamine disulfides THE GOODYEAR TIRE & RUBBER COMPANY (US) 2002-03-13 EP disclosed
EP-0700963-B1 Polymeric N-aryl substituted and N-alkaryl substituted diphenyldiamines GOODYEAR TIRE & RUBBER (US) 1999-04-14 EP disclosed
US-5726248-A ANTIOXIDANTS FOR DIENE POLYMERS WITH HIGH MOLECULAR WEIGHTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1998-03-10 US disclosed
EP-0700963-A1 Polymeric N-aryl substituted and N-alkaryl substituted diphenyldiamines THE GOODYEAR TIRE & RUBBER COMPANY (US) 1996-03-13 EP disclosed