SCHEMBL672957

SCHEMBL672957

CN(C)c1ccc(C(=CCCCN)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.44
TSHR P16473 2/20 0.44
CYP3A4 P08684 2/20 0.44
MAPK1 P28482 2/20 0.44
HBB P68871 1/20 0.44
BCL2L1 Q07817 2/20 0.44
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
MAPT P10636 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
ESR1 P03372 5/20 0.38
ESR2 Q92731 5/20 0.38
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA2 P00918 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
SCHEMBL674431 0.83 ALDH1A1 (0.43) TSHRCYP3A4MAPK1BCL2L1ALDH1A1
SCHEMBL4897408 0.79 ALDH1A1 (0.52) ALOX15TSHRCYP3A4MAPK1HBB
SCHEMBL14099863 0.73 RAB9A (0.58) MAPK1ALDH1A1HPGDMAPTRAB9A
SCHEMBL8269356 0.71 ALDH1A1 (0.52) ALOX15TSHRCYP3A4MAPK1HBB
SCHEMBL6937372 0.71 ALDH1A1 (0.56) ALOX15TSHRCYP3A4MAPK1HBB
SCHEMBL9815915 0.71 ALDH1A1 (0.56) ALOX15TSHRCYP3A4MAPK1HBB
SCHEMBL5092012 0.71 SIGMAR1 (0.51) SIGMAR1
SCHEMBL465252 0.70 APP (0.50) ALOX15HBBALDH1A1MAPTRAB9A
SCHEMBL672956 0.70 ALDH1A1 (0.44) TSHRALDH1A1MAPTSIGMAR1TP53
SCHEMBL9750091 0.69 ALDH1A1 (0.50) TSHRMAPK1ALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1873168-B1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORP (JP) 2012-12-12 EP claimed
US-7671136-B2 Modified polymers prepared with lanthanide-based catalysts BRIDGESTONE CORPORATION (JP) 2010-03-02 US claimed
US-20090292043-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORPORATION (JP) 2009-11-26 US claimed
EP-1873168-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES Bridgestone Corporation (JP) 2008-01-02 EP claimed
US-20060025539-A1 Modified polymers prepared with lanthanide-based catalysts OZAWA YOICHI 2006-02-02 US claimed
US-6977281-B1 Modified polymers prepared with lanthanide-based catalysts BRIDGESTONE CORPORATION (JP) 2005-12-20 US claimed
EP-1873168-B1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORP (JP) 2012-12-12 EP disclosed
US-7968652-B2 Modified conjugated diene copolymer, rubber compositions and tires BRIDGESTONE CORPORATION (JP) 2011-06-28 US disclosed
US-20090292043-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORPORATION (JP) 2009-11-26 US disclosed
EP-1873168-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES Bridgestone Corporation (JP) 2008-01-02 EP disclosed
EP-1237935-B1 MODIFIED POLYMERS PREPARED WITH LANTHANIDE-BASED CATALYSTS BRIDGESTONE CORP (JP) 2007-01-24 EP disclosed
EP-1237935-A1 MODIFIED POLYMERS PREPARED WITH LANTHANIDE-BASED CATALYSTS Bridgestone Corporation (JP) 2002-09-11 EP disclosed
WO-2001034659-A1 MODIFIED POLYMERS PREPARED WITH LANTHANIDE-BASED CATALYSTS BRIDGESTONE CORPORATION (JP) 2001-05-17 WO disclosed