SCHEMBL7182816

SCHEMBL7182816

CCCCCCCCCCCCCCCCCCCCCCNCC(C)NCC(C)N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.49
ERAP2 Q6P179 1/20 0.49
TSHR P16473 2/20 0.43
ALDH1A1 P00352 1/20 0.43
OPRM1 P35372 1/20 0.39
EPHX1 P07099 4/20 0.36
ADH1B P00325 2/20 0.36
ADH1C P00326 2/20 0.36
ADH1A P07327 2/20 0.36
ADH4 P08319 2/20 0.36
ADH7 P40394 2/20 0.36
TP53 P04637 1/20 0.36
S1PR2 O95136 5/20 0.34
S1PR4 O95977 5/20 0.34
S1PR1 P21453 5/20 0.34
S1PR3 Q99500 5/20 0.34
S1PR5 Q9H228 1/20 0.34
RRM1 P23921 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
DPP7 Q9UHL4 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
SCHEMBL4817560 1.00 ANPEP (0.49) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL3796247 1.00 ANPEP (0.49) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL338761 1.00 ANPEP (0.49) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL9257001 1.00 ANPEP (0.49) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL4631063 1.00 ANPEP (0.49) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL407267 1.00 ANPEP (0.49) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL3459403 1.00 ANPEP (0.49) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL7190385 0.98 ANPEP (0.47) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL4817694 0.98 ANPEP (0.47) ANPEPERAP2TSHRALDH1A1OPRM1
SCHEMBL4823429 0.98 ANPEP (0.47) ANPEPERAP2TSHRALDH1A1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4511369-A DUEL BASICITY FLUX INSTITUT FRANCAIS DU PETROLE (FR) 1985-04-16 US claimed
EP-0899006-B1 Liquid amine composition for emulsifiers for bitumen KAO CORP (JP) 2003-10-29 EP disclosed
US-6048905-A CONTROLLED VISCOSITY ADJUVANT MIXTURES WHICH ACT AS STABILIZERS AND/OR ADHESIVES TO PROMOTE EASE OF HANDLING IN ASPHALT MIXTURES KAO CORPORATION (JP) 2000-04-11 US disclosed
EP-0899006-A2 Liquid amine composition for emulsifiers for bitumen Kao Corporation (JP) 1999-03-03 EP disclosed
US-5472624-A Wear resistance, extreme pressure lubricant INSTITUT FRANCAIS DU PETROLE (FR) 1995-12-05 US disclosed
US-4657957-A Binding agent aqueous dispersions having improved coagulation properties SANDOZ LTD. (CH) 1987-04-14 US disclosed
US-4511369-A DUEL BASICITY FLUX INSTITUT FRANCAIS DU PETROLE (FR) 1985-04-16 US disclosed