SCHEMBL733022

SCHEMBL733022

C=C(C)C(=O)NC(C)N1CCNCC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.40
CHRM3 P20309 1/20 0.40
TGFBR1 P36897 1/20 0.36
SIGMAR1 Q99720 2/20 0.35
CYP1A2 P05177 1/20 0.34
OPRD1 P41143 3/20 0.34
GNAI3 P08754 1/20 0.30
GNAO1 P09471 1/20 0.30
GNAI1 P63096 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL7615098 0.81 TGFBR1 (0.37) TGFBR1SIGMAR1CYP1A2RXFP1
SCHEMBL1070950 0.79 SMN1; SMN2 (0.42) TGFBR1
SCHEMBL6632269 0.78 CHRM5 (0.44) CHRM5CHRM3SIGMAR1CYP1A2OPRD1
SCHEMBL9807354 0.77 ALDH1A1 (0.36) TGFBR1CYP1A2
SCHEMBL11108303 0.77 CHRM5 (0.43) CHRM5CHRM3SIGMAR1CYP1A2OPRD1
SCHEMBL730166 0.76 TSHR (0.47) CHRM5CHRM3SIGMAR1CYP1A2OPRD1
SCHEMBL295308 0.76 TGFBR1 (0.33) CHRM5CHRM3TGFBR1RXFP1
SCHEMBL9331350 0.70 CHRM5 (0.38) CHRM5CHRM3SIGMAR1CYP1A2OPRD1
SCHEMBL3127868 0.70 CA1 (0.41) CHRM5CHRM3SIGMAR1
SCHEMBL9807347 0.69 TSHR (0.35) CHRM5CHRM3SIGMAR1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3063210-A2 METHOD OF THIOPHENOL REMOVAL FROM POLY(ARYLENE SULFIDE) POLYMER COMPOSITIONS SOLVAY SA (BE) 2016-09-07 EP disclosed
US-9388282-B2 Method of thiophenol removal from poly(arylene sulfide) polymer compositions SOLVAY SPECIALTY POLYMERS USA, LLC. (US) 2016-07-12 US disclosed
WO-2015065906-A2 METHOD OF THIOPHENOL REMOVAL FROM POLY(ARYLENE SULFIDE) POLYMER COMPOSITIONS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2015-05-07 WO disclosed
US-20150119550-A1 Method of Thiophenol Removal from Poly(Arylene Sulfide) Polymer Compositions CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2015-04-30 US disclosed
US-8889802-B2 Polymer compositions and methods of making and using same POLYMERIGHT, INC. (US) 2014-11-18 US disclosed
US-20120130040-A1 Polymer Compositions and Methods of Making and Using Same POLYMERIGHT, INC. (US) 2012-05-24 US disclosed
EP-2448990-A1 POLYMER COMPOSITIONS AND METHODS OF MAKING AND USING SAME Polymeright Inc. (US) 2012-05-09 EP disclosed
US-8138278-B2 Polymer compositions and methods of making and using same POLYMERIGHT, INC. (US) 2012-03-20 US disclosed
US-20110152492-A1 Polymer Compositions and Methods of Making and Using Same POLYMERIGHT, INC. (US) 2011-06-23 US disclosed
WO-2011008480-A1 POLYMER COMPOSITIONS AND METHODS OF MAKING AND USING SAME POLYMERIGHT, INC. (US) 2011-01-20 WO disclosed
US-7585932-B2 Polymer compositions and processes for making and using same CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2009-09-08 US disclosed
EP-1940917-A2 POLYMER COMPOSITIONS AND PROCESSES FOR MAKING AND USING SAME Chevron Phillips Chemical Company LP (US) 2008-07-09 EP disclosed
US-20070055033-A1 POLYMER COMPOSITIONS AND PROCESSES FOR MAKING AND USING SAME CHEVRON PHILLIPS CHEMICAL COMPANY, LP 2007-03-08 US disclosed
WO-2007021960-A2 POLYMER COMPOSITIONS AND PROCESSES FOR MAKING AND USING SAME CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2007-02-22 WO disclosed
EP-0394792-A1 (Meth)acrylic acid derivatives containing formyl piperazine groups BAYER AG (DE) 1990-10-31 EP disclosed