SCHEMBL1421157

SCHEMBL1421157

CC(N)CCC(N)CCCCN

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
GSR P00390 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
TRPA1 O75762 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA3 P07451 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
DNM1 Q05193 1/20 0.33

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
SCHEMBL8642555 0.98 OPRM1 (0.42) OPRM1GSRTRPV1TRPA1CA12
SCHEMBL28527284 0.93 OPRM1 (0.42) OPRM1TRPV1TRPA1ALDH1A1TP53
SCHEMBL2888117 0.92 OPRM1 (0.40) OPRM1TRPV1TRPA1ALDH1A1TP53
SCHEMBL4580204 0.92 OPRM1 (0.40) OPRM1TRPV1TRPA1ALDH1A1TP53
SCHEMBL13387918 0.90 OPRM1 (0.50) OPRM1GSRTRPV1TRPA1TP53
SCHEMBL2357722 0.87 NFKB1 (0.47) GSRTRPV1NFKB1CA12CA1
SCHEMBL11084535 0.84 GSR (0.44) GSRALDH1A1NFKB1CA12CA1
SCHEMBL13923499 0.84
SCHEMBL16130885 0.84
SCHEMBL34359 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105899579-B Daiamid composition 罗地亚经营管理公司 2019-05-21 CN claimed
CN-109749053-A A kind of dispersions of polyurethanes and preparation method thereof containing polycarbodiimide 华南理工大学 2019-05-14 CN claimed
EP-2454304-B1 FORMAMIDE-CONTAINING REACTIVE SYSTEMS BAYER IP GMBH (DE) 2013-10-23 EP claimed
EP-1678230-B1 TWO-COMPONENT POLYURETHANE COMPOUND EXHIBITING A HIGH EARLY STRENGTH SIKA TECHNOLOGY AG (CH) 2011-12-21 EP claimed
EP-1716197-B1 HIGHLY FUNCTIONAL, HIGHLY BRANCHED POLYUREAS BASF SE (DE) 2008-10-29 EP claimed
EP-1716197-A1 HIGHLY FUNCTIONAL, HIGHLY BRANCHED POLYUREAS BASF AKTIENGESELLSCHAFT (DE) 2006-11-02 EP claimed
WO-2005075541-A1 HIGHLY FUNCTIONAL, HIGHLY BRANCHED POLYUREAS BASF AKTIENGESELLSCHAFT (DE) 2005-08-18 WO claimed
EP-1157272-B1 OIL QUALITY SENSOR AND METHOD FOR PRODUCING THE SAME VOLKSWAGEN AG (DE) 2003-08-20 EP claimed
EP-0193154-B1 POTENTIAL-CAUSING ELEMENT FOR IMMUNOSENSOR Juridical Foundation The Chemo-Sero-Therapeutic Research Institute (JP) 1992-01-29 EP claimed
EP-0193154-A2 Potential-causing element for immunosensor Juridical Foundation The Chemo-Sero-Therapeutic Research Institute (JP) 1986-09-03 EP claimed
CN-104845352-B Flame-retardant polyurethane foams and its manufacturing method 东曹株式会社 2019-09-10 CN disclosed
CN-110072906-A Epobond epoxyn with high compression-strength SIKA技术股份公司 2019-07-30 CN disclosed
CN-110072905-A Curing agent for cold-setting epoxy resin adhesive having rapid curing properties SIKA技术股份公司 2019-07-30 CN disclosed
CN-109803992-A The manufacturing method of isocyanate composition and isocyanate polymer 旭化成株式会社 2019-05-24 CN disclosed
CN-105899579-B Daiamid composition 罗地亚经营管理公司 2019-05-21 CN disclosed
EP-0314009-A2 Functionalized conductive polymers and their use in diagnostic devices MILES INC. (US) 1989-05-03 EP disclosed
US-4621104-A OF BUTYNEDIOL AND ALKYLENE OXIDE BAYER AKTIENGESELLSCHAFT (DE) 1986-11-04 US disclosed
EP-0193154-A2 Potential-causing element for immunosensor Juridical Foundation The Chemo-Sero-Therapeutic Research Institute (JP) 1986-09-03 EP disclosed
US-4399269-A CURING AGENTS FOR EPOXY RESINS MILLIKEN RESEARCH CORPORATION (US) 1983-08-16 US disclosed
US-4362894-A Poly-(-2-aminoalkyl)polyamines MILLIKEN RESEARCH CORPORATION (US) 1982-12-07 US disclosed