SCHEMBL3477243

SCHEMBL3477243

Fc1nc(Cl)ccc1-c1ccc2c(nnn2CC2CC2)c1Cl

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 15/20 0.54
TDO2 P48775 3/20 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
SCHEMBL3475341 0.88 GRM2 (0.49) GRM2TDO2
SCHEMBL3475602 0.86 GRM2 (0.47) GRM2TDO2
SCHEMBL13727187 0.86 GRM2 (0.50) GRM2TDO2
SCHEMBL3475495 0.84 GRM2 (0.52) GRM2TDO2
SCHEMBL3474795 0.82 GRM2 (0.62) GRM2TDO2
SCHEMBL3474611 0.81 GRM2 (0.49) GRM2TDO2
SCHEMBL3475381 0.81 GRM2 (0.53) GRM2TDO2
SCHEMBL3476538 0.79 GRM2 (0.52) GRM2TDO2
SCHEMBL3476498 0.79 GRM2 (0.51) GRM2TDO2
SCHEMBL3476190 0.79 GRM2 (0.51) GRM2TDO2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010141360-A1 BIARYL BENZOTRIAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2010-12-09 WO claimed
WO-2010141360-A1 BIARYL BENZOTRIAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2010-12-09 WO disclosed
WO-2010141360-A1 BIARYL BENZOTRIAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2010-12-09 WO disclosed