SCHEMBL4811228

SCHEMBL4811228

CCCCCC(C)OOC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.39
FAAH O00519 5/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
SMPD1 P17405 3/20 0.34
CA1 P00915 2/20 0.33
SPHK1 Q9NYA1 1/20 0.33
TP53 P04637 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
ADH7 P40394 1/20 0.31
CA2 P00918 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
SCHEMBL1116716 0.98 FAAH (0.39) OPRM1FAAHCNR1CNR2SMPD1
SCHEMBL987910 0.93 CTSK (0.33) OPRM1FAAHCA1CA2
SCHEMBL11645650 0.84 TSHR (0.33)
SCHEMBL8213474 0.82 FAAH (0.37) OPRM1FAAHCNR1CNR2SMPD1
SCHEMBL167171 0.81 TSHR (0.39)
SCHEMBL8039293 0.81 OPRM1 (0.50) OPRM1FAAHCNR1CNR2CA1
SCHEMBL510082 0.80 SMPD1 (0.44) OPRM1SMPD1LMNACA2
SCHEMBL10595657 0.80 LMNA (0.39) LMNA
SCHEMBL9070552 0.79
SCHEMBL30450150 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7354655-B2 Adhesive resin composition and multi-layer laminated structure using the same JAPAN POLYOLEFINS CO., LTD. (JP) 2008-04-08 US disclosed
US-20030175538-A1 Adhesive resin composition and multi-layer laminated structure using the same JAPAN POLYOLEFINS CO., LTD. 2003-09-18 US disclosed
EP-1298168-A9 ADHESIVE RESIN COMPOSITION AND MULTILAYER STRUCTURE MADE WITH THE SAME Japan Polyolefins Co., Ltd. (JP) 2003-07-30 EP disclosed
EP-1298168-A1 ADHESIVE RESIN COMPOSITION AND MULTILAYER STRUCTURE MADE WITH THE SAME Japan Polyolefins Co., Ltd. (JP) 2003-04-02 EP disclosed