SCHEMBL3669858

SCHEMBL3669858

C=Cc1ccc(CCOCCN(CC)CC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
BIRC5 O15392 1/20 0.40
KDM4E B2RXH2 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
HTT P42858 2/20 0.38
LTA4H P09960 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KCNH2 Q12809 2/20 0.37
CHRM2 P08172 2/20 0.36
CHRM1 P11229 2/20 0.36
DRD3 P35462 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 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
SCHEMBL3668335 0.86 CHRNB2 (0.36) MEN1POLBKMT2ABIRC5KCNH2
SCHEMBL3672391 0.86 MEN1 (0.47) MEN1POLBKMT2ABIRC5CYP1A2
SCHEMBL3672602 0.84 HRH3 (0.45) KDM4ELTA4HKCNH2CHRNB2CHRNB4
SCHEMBL93912 0.83 ALDH1A1 (0.42) KDM4ECYP2D6KCNH2CHRM2CHRM1
SCHEMBL2402230 0.83 ALDH1A1 (0.50) POLBKCNH2CHRNB2CHRNB4CHRNA3
SCHEMBL10883391 0.81 KCNH2 (0.44) BIRC5KDM4EKCNH2CHRM2CHRM1
SCHEMBL6811284 0.80 KCNH2 (0.55) MEN1KMT2ABIRC5KDM4ECYP1A2
SCHEMBL1592709 0.80 ALDH1A1 (0.42) KDM4EKCNH2SMN1; SMN2CHRNB2CHRNB4
SCHEMBL6812250 0.79 KCNH2 (0.51) BIRC5KCNH2CHRM2CHRM1DRD3
SCHEMBL30527517 0.79 CYP2D6 (0.50) BIRC5KDM4ECYP1A2CYP2D6HTT

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1298166-B1 RUBBER COMPOSITION JSR CORP (JP) 2007-02-21 EP claimed
US-6699935-B2 A CROSSLINKED RUBBER PARTICLES CONTAINING CONJUGATED DIENE MONOMER, AROMATIC VINYL MONOMER AND MONOMER WITH AT LEAST TWO POLYMERIZABLE UNSATURATED GROUPS DISPERSED IN A CONJUGATED DIENE/AROMATIC VINYL COPOLYMER; RESIST TO ROLLING, SKID, WEAR JSR CORPORATION (JP) 2004-03-02 US claimed
US-6653404-B2 Melt processability; dimensional stability JSR CORPORATION (JP) 2003-11-25 US claimed
US-20030125467-A1 A crosslinked rubber particles containing conjugated diene monomer, aromatic vinyl monomer and monomer with at least two polymerizable unsaturated groups dispersed in a conjugated diene/aromatic vinyl copolymer; resist to rolling, skid, wear JSR CORPORATION (JP) 2003-07-03 US claimed
EP-1298166-A1 RUBBER COMPOSITION JSR Corporation (JP) 2003-04-02 EP claimed
US-20010053813-A1 Rubber compositions JSR CORPORATION (JP) 2001-12-20 US claimed
EP-1152030-B1 Rubber mixtures based on crosslinked rubber particles and non-crosslinked rubbers JSR CORP (JP) 2012-12-12 EP disclosed
EP-1149867-B1 Crosslinked rubber particles and rubber compositions JSR CORP (JP) 2010-06-16 EP disclosed
US-20080081873-A1 Thermoplastic Elastomer Composition And Method For Producing Same JSR CORPORATION (JP) 2008-04-03 US disclosed
EP-1201368-B1 Polishing pad comprising a water-insoluble substance and method for producing thereof JSR CORP (JP) 2008-01-16 EP disclosed
EP-1535960-B1 Oil resistant and weather resistant rubber composition and molded product using the same JSR CORP (JP) 2007-10-24 EP disclosed
EP-1816163-A1 THERMOPLASTIC ELASTOMER COMPOSITION AND METHOD FOR PRODUCING SAME JSR Corporation (JP) 2007-08-08 EP disclosed
EP-1298166-B1 RUBBER COMPOSITION JSR CORP (JP) 2007-02-21 EP disclosed
US-20020045691-A1 Conjugated diene-based rubber, oil extended rubber and rubber composition containing the same JSR CORPORATION (JP) 2002-04-18 US disclosed
EP-1184415-A2 Conjugated diene-based rubber, oil extended rubber and rubber composition containing the same JSR Corporation (JP) 2002-03-06 EP disclosed
US-20020007011-A1 Crosslinked rubber particles and rubber compositions JSR CORPORATION (JP) 2002-01-17 US disclosed
US-20010053813-A1 Rubber compositions JSR CORPORATION (JP) 2001-12-20 US disclosed
EP-1152030-A2 Rubber mixtures based on crosslinked rubber particles and non-crosslinked rubbers JSR Corporation (JP) 2001-11-07 EP disclosed
EP-1149866-A2 Rubber mixtures based on crosslinked rubber particles and non-crosslinked rubbers JSR Corporation (JP) 2001-10-31 EP disclosed
EP-1149867-A2 Crosslinked rubber particles and rubber compositions JSR Corporation (JP) 2001-10-31 EP disclosed