Sugi Predict

Sugi Predict / Compounds / SCHEMBL4556305

SCHEMBL4556305

SCHEMBL4556305

CCc1c(-c2nnc(C(C)CC)s2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1.CCc1c(-c2nnc(C3CCCCCC3)s2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 12/20 0.53
▸ CNR1 P21554 7/20 0.47

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
SCHEMBL921917 0.92 CNR2 (0.60) CNR2CNR1
SCHEMBL922910 0.92 CNR2 (0.60) CNR2CNR1
SCHEMBL924921 0.91 CNR2 (0.61) CNR2CNR1
SCHEMBL4555935 0.90 CNR2 (0.60) CNR2CNR1
SCHEMBL923199 0.90 CNR2 (0.59) CNR2CNR1
SCHEMBL925053 0.89 CNR2 (0.55) CNR2CNR1
SCHEMBL923885 0.87 CNR2 (0.62) CNR2CNR1
SCHEMBL923143 0.87 CNR2 (0.62) CNR2CNR1
SCHEMBL923046 0.86 CNR2 (0.63) CNR2CNR1
SCHEMBL922744 0.85 CNR2 (0.61) 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-2097410-A1 HETEROARYL-PYRAZOLE DERIVATIVES AS CANNABINOID CB1 RECEPTOR ANTAGONISTS Green Cross Corporation (KR) 2009-09-09 — — EP disclosed
WO-2008039023-A1 HETEROARYL-PYRAZOLE DERIVATIVES AS CANNABINOID CB1 RECEPTOR ANTAGONISTS GREEN CROSS CORPORATION (KR) 2008-04-03 — — WO disclosed