SCHEMBL9190098

SCHEMBL9190098

CCCCCCCCc1ccc(OCCC[C@H]2CC[C@H](CCCCC)CC2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.52
CNR1 P21554 6/20 0.48
TSHR P16473 1/20 0.41
GPR119 Q8TDV5 1/20 0.41

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
SCHEMBL9182942 1.00 CNR2 (0.52) CNR2CNR1TSHRGPR119
SCHEMBL9182936 1.00 CNR2 (0.52) CNR2CNR1TSHRGPR119
SCHEMBL9190107 1.00 CNR2 (0.52) CNR2CNR1TSHRGPR119
SCHEMBL9183713 0.99 CNR2 (0.50) CNR2CNR1GPR119
SCHEMBL9183723 0.99 CNR2 (0.50) CNR2CNR1GPR119
SCHEMBL9186045 0.95 CNR2 (0.47) CNR2CNR1GPR119
SCHEMBL9186048 0.95 CNR2 (0.47) CNR2CNR1GPR119
SCHEMBL10709360 0.94 CNR2 (0.47) CNR2CNR1GPR119
SCHEMBL10710070 0.92 CNR2 (0.49) CNR2CNR1
SCHEMBL10709889 0.92 CNR2 (0.49) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0423520-B1 Liquid crystalline composition for the use in a twisted nematic cell MERCK PATENT GMBH (DE) 1995-08-02 EP disclosed
EP-0423520-A2 Liquid crystalline composition for the use in a twisted nematic cell MERCK PATENT GmbH (DE) 1991-04-24 EP disclosed