SCHEMBL11641992

SCHEMBL11641992

CCCCCOc1cc(CCCC2CCCC2)cc2c1C1=C(CCN(C#N)C1)C(C)(C)O2

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 8/20 0.41
▸ CNR1 P21554 7/20 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
SCHEMBL11637651 0.88 CNR2 (0.47) CNR2CNR1
SCHEMBL11636642 0.84 CNR2 (0.49) CNR2CNR1
SCHEMBL11642565 0.78 CNR2 (0.31) CNR2CNR1
Hydrochloric Acid SCHEMBL11718038 0.78 CNR2 (0.42) CNR2CNR1
SCHEMBL11636529 0.78 CNR2 (0.65) CNR2CNR1
SCHEMBL11642448 0.77 CNR2 (0.67) CNR2CNR1
SCHEMBL11714195 0.71 CNR2 (0.61) CNR2CNR1
Hydrochloric Acid SCHEMBL11718033 0.69 CNR2 (0.43) CNR2CNR1
SCHEMBL11642368 0.69 CNR2 (0.48) CNR2CNR1
SCHEMBL11638949 0.69 CNR2 (0.34) 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
US-4096265-A HYPOTENSIVE AGENTS SHARPS ASSOCIATES (US) 1978-06-20 — — US disclosed
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