SCHEMBL8628442

SCHEMBL8628442

CCCCCCCCCc1cc[c]cc1OCCCCCCCCC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.39
CNR1 P21554 9/20 0.39
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36
CEL P19835 1/20 0.36
PPARG P37231 1/20 0.34
HTR1A P08908 1/20 0.34
HTR1D P28221 1/20 0.34
HTR1B P28222 1/20 0.34
NAAA Q02083 1/20 0.34
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34

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
SCHEMBL8623977 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8626652 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8625308 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8630655 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8624595 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8626614 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8623531 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8630397 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8626175 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL
SCHEMBL8627032 1.00 CNR2 (0.39) CNR2CNR1CYP1A2HPGDCEL

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-5759443-A Cyclopentyl derivatives ROLIC AG (CH) 1998-06-02 US disclosed