SCHEMBL4767952

SCHEMBL4767952

[CH]1CCNC[C@H]1CCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GLB1 P16278 1/20 0.37
GBA2 Q9HCG7 1/20 0.37
GBA1 P04062 1/20 0.37
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL9820951 0.87 CYP19A1 (0.40) SIGMAR1
SCHEMBL7297794 0.87 CYP19A1 (0.40) SIGMAR1
SCHEMBL15229389 0.82 GBA1 (0.47) GBA1
SCHEMBL27644423 0.76 KCNA3 (0.41)
SCHEMBL6570849 0.73 SLC18A2 (0.47)
SCHEMBL3044569 0.71 GBA1 (0.56) GBA1
SCHEMBL6567840 0.71 SLC18A2 (0.46)
SCHEMBL5556878 0.70 LTA4H (0.54) GLB1GBA2
SCHEMBL3817645 0.70 LTA4H (0.54) GLB1GBA2
SCHEMBL293097 0.70

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-2007733-A1 AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2008-12-31 EP disclosed
WO-2007113596-A1 AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2007-10-11 WO disclosed