SCHEMBL8979964

SCHEMBL8979964

CCCCC(C)OC(C)N

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
SPHK1 Q9NYA1 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
TP53 P04637 1/20 0.35
SLC15A1 P46059 1/20 0.35
DNM1 Q05193 2/20 0.35
DPP7 Q9UHL4 2/20 0.32
DPP8 Q6V1X1 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
FAAH O00519 1/20 0.32
CYP3A4 P08684 1/20 0.31
LAP3 P28838 1/20 0.31

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
SCHEMBL2099612 0.85 OPRM1 (0.44) OPRM1SPHK1ALDH1A1TDP1TP53
SCHEMBL635647 0.84 DNM1 (0.41) OPRM1ALDH1A1TDP1DNM1CA1
SCHEMBL8979970 0.82 OPRM1 (0.46) OPRM1SPHK1ALDH1A1TDP1TP53
SCHEMBL8979932 0.81 OPRM1 (0.41) OPRM1SPHK1ALDH1A1TDP1TP53
SCHEMBL3263688 0.81 ALDH1A1 (0.43) OPRM1SPHK1ALDH1A1TDP1TP53
SCHEMBL15299174 0.79 DNM1 (0.38) OPRM1ALDH1A1TDP1DNM1CA1
SCHEMBL24087980 0.78 OPRM1 (0.54) OPRM1SPHK1ALDH1A1TDP1TP53
SCHEMBL14815360 0.78 OPRM1 (0.34) OPRM1
SCHEMBL9332020 0.76 OPRM1 (0.37) OPRM1SPHK1ALDH1A1TDP1TP53
SCHEMBL1484167 0.76 OPRM1 (0.50) OPRM1SPHK1TP53DNM1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0576445-B1 A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS SAN MARTINO SPA (IT) 1996-05-15 EP claimed
WO-1992016346-A1 A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS SILVANI ANTINCENDI S.P.A (IT) 1992-10-01 WO claimed
EP-0576445-B1 A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS SAN MARTINO SPA (IT) 1996-05-15 EP disclosed
US-5468422-A Composition for use in washing and cleansing vulcanization molds SILVANI ANTINCEDI (IT) 1995-11-21 US disclosed
EP-0576445-A1 A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS. SILVANI ANTINCENDI SPA (IT) 1994-01-05 EP disclosed
WO-1992016346-A1 A COMPOSITION FOR USE IN WASHING AND CLEANSING VULCANIZATION MOLDS SILVANI ANTINCENDI S.P.A (IT) 1992-10-01 WO disclosed