SCHEMBL16201688

SCHEMBL16201688

CCCCCn1cc(C(=O)c2ccc(O)cc2)c2ccccc21

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.80
CNR1 P21554 14/20 0.80

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
SCHEMBL15478842 0.87 CNR2 (0.75) CNR2CNR1
SCHEMBL29358966 0.87 CNR2 (0.75) CNR2CNR1
SCHEMBL10647543 0.85 KMT2A (0.59) CNR2CNR1
SCHEMBL27365070 0.85 CNR2 (0.63) CNR2CNR1
SCHEMBL27311977 0.85 SRD5A1 (0.64) CNR2CNR1
SCHEMBL7853735 0.84 CNR1 (0.70) CNR2CNR1
SCHEMBL27034080 0.83 CNR2 (0.69) CNR2CNR1
SCHEMBL11983565 0.81 CNR2 (0.78) CNR2CNR1
SCHEMBL10650584 0.81 KMT2A (0.61) CNR2CNR1
SCHEMBL11903673 0.81 CNR2 (0.74) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014176542-A1 NUCLEAR MAGNETIC RESONANCE IMPLEMANTED SYNTHETIC INDOLE AND INDAZOLE CANNABINOID DENTECTION, IDENTIFICATION, AND QUANTIFICATION HOFSTRA UNIVERSITY (US) 2014-10-30 WO disclosed