SCHEMBL10011705

SCHEMBL10011705

C[CH]OC(C)CCCCC

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.42
FAAH O00519 5/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
CA1 P00915 2/20 0.35
SPHK1 Q9NYA1 1/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL3317088 0.98 OPRM1 (0.41) OPRM1FAAHADH1BADH1CADH1A
SCHEMBL3314268 0.98 OPRM1 (0.41) OPRM1FAAHADH1BADH1CADH1A
SCHEMBL3317097 0.98 OPRM1 (0.41) OPRM1FAAHADH1BADH1CADH1A
SCHEMBL3315102 0.93
SCHEMBL3315434 0.82
SCHEMBL8069692 0.80 FAAH (0.39) OPRM1FAAHADH1BADH1CADH1A
SCHEMBL8069696 0.80 FAAH (0.39) OPRM1FAAHADH1BADH1CADH1A
SCHEMBL13037388 0.79 ADH1B (0.45) OPRM1FAAHADH1BADH1CADH1A
SCHEMBL93267 0.79 ADH1B (0.45) OPRM1FAAHADH1BADH1CADH1A
SCHEMBL14093584 0.77 ADH1B (0.48) OPRM1FAAHADH1BADH1CADH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120168219-A1 ACTIVE RESIN COMPOSITION, SURFACE MOUNTING METHOD AND PRINTED WIRING BOARD SAN-EI KAGAKU CO., LTD (JP) 2012-07-05 US disclosed