SCHEMBL1979160

SCHEMBL1979160

C(#CC1CC1)c1[c]cccn1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
GRM5 P41594 1/20 0.41
KCNH2 Q12809 1/20 0.32

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
SCHEMBL4723350 0.74
SCHEMBL16289784 0.72
SCHEMBL1200558 0.68 APP (0.46) CYP1A2GRM5KCNH2
SCHEMBL1201321 0.67
SCHEMBL5050099 0.67
SCHEMBL4618243 0.67
SCHEMBL131953 0.67
SCHEMBL1977971 0.65 KCNH2 (0.41) CYP1A2GRM5KCNH2
SCHEMBL29856498 0.62 CYP1A2 (0.44) CYP1A2GRM5KCNH2
SCHEMBL944190 0.61

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
WO-2013153535-A1 TRICYCLIC COMPOUNDS AS mPGES-1 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2013-10-17 WO disclosed
WO-2011072064-A1 S PIRO [CHROMAN - 4, 4 ' - IMIDAZOL] ONES AS BETA - SECRETASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-06-16 WO disclosed