SCHEMBL9327670

SCHEMBL9327670

CCCCNCCN1CC(C)(C)N(C)C(C)(C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.35
OPRD1 P41143 6/20 0.35
OPRK1 P41145 6/20 0.35
OPRL1 P41146 6/20 0.35
CYP1A2 P05177 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.30
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
SCHEMBL9329350 0.78 OPRM1 (0.34) OPRM1OPRD1OPRK1OPRL1CYP1A2
SCHEMBL9329812 0.73
SCHEMBL9329224 0.71 OPRM1 (0.38) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL9782964 0.70 OPRM1 (0.37) OPRM1OPRD1OPRK1OPRL1
SCHEMBL9782969 0.69 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1
SCHEMBL6289546 0.66 KMT2A (0.46) ALDH1A1SMN1; SMN2
SCHEMBL7697838 0.66 CYP19A1 (0.35) OPRM1OPRL1
SCHEMBL6284765 0.64 PER2 (0.34) OPRM1OPRD1OPRK1OPRL1CYP1A2
SCHEMBL7246872 0.62 ACE2 (0.42) OPRM1OPRD1OPRK1OPRL1CYP1A2
SCHEMBL9488575 0.62 TSHR (0.37) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992004404-A2 THERMOOXIDATIVE STABILIZATION OF POLYOLEFINS WITH AN OXO-PIPERAZINYL-TRIAZINE AND A PHOSPHOROUS ACID ESTER THE B.F. GOODRICH COMPANY (US) 1992-03-19 WO claimed
US-5278209-A Oxidation resistance B.F. GOODRICH COMPANY, THE 1994-01-11 US disclosed
US-5240977-A Mixture of oxopiperazinyl-triazine and 3,5-disubstituted tert-butyl 4-hydroxybenzoate THE B. F. GOODRICH COMPANY (US) 1993-08-31 US disclosed
EP-0548293-A1 THERMOOXIDATIVE STABILIZATION OF POLYOLEFINS WITH AN OXO-PIPERAZINYL-TRIAZINE AND A PHOSPHOROUS ACID ESTER THE B.F. GOODRICH COMPANY (US) 1993-06-30 EP disclosed
WO-1992004404-A2 THERMOOXIDATIVE STABILIZATION OF POLYOLEFINS WITH AN OXO-PIPERAZINYL-TRIAZINE AND A PHOSPHOROUS ACID ESTER THE B.F. GOODRICH COMPANY (US) 1992-03-19 WO disclosed