SCHEMBL24673406

SCHEMBL24673406

CCOC(CCCCC/C=C\CCCCl)OCC

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
FAAH O00519 5/20 0.33
TRPV1 Q8NER1 1/20 0.31
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL29992243 1.00 CNR1 (0.34) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL29992326 1.00 CNR1 (0.34) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL29621518 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL29621017 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL29621310 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL19458671 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL19458798 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL29621397 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL19458703 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1
SCHEMBL29621566 0.93 FAAH (0.33) CNR1CNR2FAAHTRPV1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4063376-B1 11-HALO-1,1-DIALKOXY-7-UNDECENE COMPOUND AND PROCESSES FOR PREPARING A 11,11-DIALKOXY-4-UNDECENYLTRIARYLPHOSPHONIUM HALIDE COMPOUND, A TRIENAL COMPOUND, AND A DIENAL COMPOUND SHINETSU CHEMICAL CO (JP) 2023-11-22 EP disclosed
EP-4063376-A1 11-HALO-1,1-DIALKOXY-7-UNDECENE COMPOUND AND PROCESSES FOR PREPARING A 11,11-DIALKOXY-4-UNDECENYLTRIARYLPHOSPHONIUM HALIDE COMPOUND, A TRIENAL COMPOUND, AND A DIENAL COMPOUND Shin-Etsu Chemical Co., Ltd. (JP) 2022-09-28 EP disclosed
CN-115109088-A Substituted undecene compounds and substituted undecenyltriarylphosphonium halides and methods of making compounds and mixtures therefrom 信越化学工业株式会社 2022-09-27 CN disclosed