SCHEMBL3389599

SCHEMBL3389599

CCNC(C)N1CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.35
CHRM3 P20309 1/20 0.35
OPRD1 P41143 6/20 0.34
SIGMAR1 Q99720 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
OPRM1 P35372 3/20 0.31
SMN1; SMN2 Q16637 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
Methylpiperazine SCHEMBL9443629 0.92 CHRM5 (0.32) CHRM5CHRM3OPRD1SIGMAR1
SCHEMBL9481171 0.79
SCHEMBL1263669 0.78 POLB (0.38) CHRM5CHRM3OPRD1SIGMAR1SLC6A2
SCHEMBL28944208 0.78 CHRM5 (0.36) CHRM5CHRM3OPRD1SIGMAR1SMN1; SMN2
SCHEMBL506127 0.78 SIGMAR1 (0.34) CHRM5CHRM3SIGMAR1GNAI3GNAO1
SCHEMBL25329312 0.77 GNAO1 (0.53) SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL8573059 0.77 GNAO1 (0.53) SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL2003708 0.77 ALDH1A1 (0.31)
SCHEMBL9317068 0.77 SIGMAR1 (0.37) CHRM5CHRM3OPRD1SIGMAR1MEN1
SCHEMBL28366615 0.76 HSD17B10 (0.49) CHRM5CHRM3SIGMAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1323814-B1 Fuel additive compositions containing a Mannich condensation product, a poly(oxyalkylene) monool, and a carboxylic acid CHEVRON ORONITE CO (US) 2010-12-15 EP disclosed
EP-1375629-B1 A method of improving the compatibility of a fuel additive composition containing a Mannich condensation product CHEVRON ORONITE CO (US) 2009-09-30 EP disclosed
US-6749651-B2 PREVENT AND CONTROL ENGINE DEPOSITS, PARTICULARLY INTAKE VALVE DEPOSITS; IMPROVED COMPATIBILITY CHEVRON ORONITE COMPANY LLC 2004-06-15 US disclosed
US-6733551-B2 BLENDING TOGETHER MANNICH CONDENSATION PRODUCT OF HIGH MOLECULAR WEIGHT ALKYL-SUBSTITUTED HYDROXYAROMATIC COMPOUND, AMINE AND ALDEHYDE, HYDROCARBYL-TERMINATED POLY(OXYALKYLENE) MONOOL, CARBOXYLIC ACID, AND SELECTED ANHYDRIDE CHEVRON ORONITE COMPANY LLC 2004-05-11 US disclosed
EP-1375629-A2 A method of improving the compatibility of a fuel additive composition containing a Mannich condensation product Chevron Oronite Company LLC (US) 2004-01-02 EP disclosed
US-20040000089-A1 Method of improving the compatibility of a fuel additive composition containing a mannich condensation product CHEVRON ORONITE COMPANY LLC 2004-01-01 US disclosed
US-20030172582-A1 Fuel additive compositions containing a mannich condensation product, a poly (oxyalkylene) monool, and a carboxylic acid CHEVRON ORONITE COMPANY LLC 2003-09-18 US disclosed
EP-1323814-A2 Fuel additive compositions containing a Mannich condensation product, a poly(oxyalkylene) monool, and a carboxylic acid Chevron Oronite Company LLC (US) 2003-07-02 EP disclosed
EP-0219035-A2 Process for the preparation of polyamines, and their use in the preparation of polyurethanes BAYER AG (DE) 1987-04-22 EP disclosed