SCHEMBL3243577

SCHEMBL3243577

CC(C)(C)Cc1nc2cc(S)ccc2n1CC1CC1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.66
CNR1 P21554 2/20 0.60

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
Acetic Acid SCHEMBL15484451 0.93 CNR2 (0.62) CNR2CNR1
SCHEMBL13605705 0.92 CNR2 (0.57) CNR2CNR1
SCHEMBL3243572 0.86 CNR2 (0.67) CNR2CNR1
SCHEMBL1335064 0.85 CNR2 (0.66) CNR2CNR1
SCHEMBL13263952 0.85 CNR2 (0.66) CNR2CNR1
SCHEMBL13605706 0.83 CNR2 (0.47) CNR2CNR1
SCHEMBL3996184 0.82 CNR2 (0.64) CNR2CNR1
SCHEMBL4005558 0.82 CNR2 (0.65) CNR2CNR1
SCHEMBL5261538 0.81 CNR2 (0.64) CNR2CNR1
SCHEMBL3367232 0.81 CNR2 (0.81) 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-2010036631-A2 COMPOUNDS WHICH SELECTIVELY MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO disclosed