SCHEMBL9647844

SCHEMBL9647844

CCCCCCCCCCCCCCCCCC(=O)NCCN1CCN=C1CCCCCCCCCCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.46
FAAH O00519 4/20 0.44
CASP2 P42575 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
OPRD1 P41143 1/20 0.40
NAAA Q02083 1/20 0.39
PLD1 Q13393 2/20 0.39
EPHX2 P34913 1/20 0.39

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
SCHEMBL9325210 1.00 DNM1 (0.46) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL9240518 1.00 DNM1 (0.46) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL9244113 1.00 DNM1 (0.46) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL9245043 1.00 DNM1 (0.46) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL9324205 1.00 DNM1 (0.46) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL9325993 1.00 DNM1 (0.46) DNM1FAAHCASP2HSD17B10TRPV1
Hydrochloric Acid SCHEMBL8993959 0.99 DNM1 (0.45) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL9240571 0.94 DNM1 (0.47) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL6241481 0.94 DNM1 (0.47) DNM1FAAHCASP2HSD17B10TRPV1
SCHEMBL9244279 0.94 DNM1 (0.47) DNM1FAAHCASP2HSD17B10TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0298326-B1 PROCESS FOR THE PRODUCTION OF 1-(ACYLAMINOALKYL)-2-IMIDAZOLINES SUBSTITUED IN POSITION 2 CASSELLA Aktiengesellschaft (DE) 1992-12-16 EP disclosed
US-5154841-A Cyclizing a polyamine with a fatty acid, ester, acyl halide or anhydride, followed by catalytic esterification with fatty acid ester or glycerides; titanium or tin alkoxides, salts, halides or alkyl halide as catalysts THE PROCTER & GAMBLE COMPANY (US) 1992-10-13 US disclosed
US-5144040-A From fatty acid, triglyceride or fatty ester and dialkylene triamine CASSELLA AKTIENGESELLSCHAFT (DE) 1992-09-01 US disclosed
US-5041553-A Reaction of dialkylenetriamine and fatty acid, cyclization CASSELLA AKTIENGESELLSCHAFT (DE) 1991-08-20 US disclosed
EP-0394376-A1 PROCESS FOR PRODUCING 1-(ACYLAMINOALKYL)-2-IMIDAZOLINES SUBSTITUTED IN THE 2 POSITION CASSELLA Aktiengesellschaft (DE) 1990-10-31 EP disclosed
EP-0375029-A2 Process for preparing substituted imidazoline fabric conditioning compounds THE PROCTER & GAMBLE COMPANY (US) 1990-06-27 EP disclosed
WO-1989008106-A1 PROCESS FOR PRODUCING 1-(ACYLAMINOALKYL)-2-IMIDAZOLINES SUBSTITUTED IN THE 2 POSITION CASSELLA AKTIENGESELLSCHAFT (DE) 1989-09-08 WO disclosed
EP-0298326-A1 Process for the production of 1-(acylaminoalkyl)-2-imidazolines substitued in position 2 CASSELLA Aktiengesellschaft (DE) 1989-01-11 EP disclosed