SCHEMBL2833308

SCHEMBL2833308

Cc1ccccc1-c1c(N)ccc(N)c1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 1/20 0.45
ADORA2A P29274 2/20 0.42
FGR P09769 1/20 0.42
PIM1 P11309 1/20 0.42
MAOA P21397 1/20 0.42
CSNK1A1 P48729 1/20 0.42
CSNK1D P48730 1/20 0.42
DYRK1A Q13627 1/20 0.42
HIPK2 Q9H2X6 1/20 0.42
CSNK1G1 Q9HCP0 1/20 0.42
HPGD P15428 2/20 0.42
NPC1 O15118 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP3A4 P08684 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL6932597 0.89 ADORA2A (0.50) ALDH1A1ADORA2AFGRPIM1MAOA
SCHEMBL6130217 0.85 HSD17B10 (0.42) ALDH1A1HSD17B10ADORA2AHPGDNPC1
SCHEMBL6130219 0.85 HSD17B10 (0.42) ALDH1A1HSD17B10ADORA2AHPGDNPC1
SCHEMBL8321808 0.83 KMT2A (0.44) ALDH1A1HSD17B10ADORA2AFGRPIM1
SCHEMBL25014 0.80 HSD17B10 (0.50) ALDH1A1HSD17B10ADORA2AFGRPIM1
SCHEMBL29546125 0.80 HSD17B10 (0.50) ALDH1A1HSD17B10ADORA2AFGRPIM1
SCHEMBL30158993 0.79 ALDH1A1 (0.45) ALDH1A1HSD17B10ADORA2AMAOAHPGD
SCHEMBL9678804 0.79 CYP3A4 (0.54) ALDH1A1HSD17B10ADORA2AFGRPIM1
SCHEMBL28203049 0.79 CYP3A4 (0.54) ALDH1A1HSD17B10ADORA2AFGRPIM1
SCHEMBL3793739 0.79 CYP3A4 (0.54) ALDH1A1HSD17B10ADORA2AMAOAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718722-B2 Alkylthio- and aryl(heteroyl)thio-substituted p-phenylenediamines, their manufacture and their use in rubber FLEXSYS AMERICA L.P. (US) 2010-05-18 US disclosed
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