SCHEMBL5328763

SCHEMBL5328763

COC1(c2ccccc2C)CCc2c(C(=O)N3CC(F)(F)C3)cn3c(C)c(C)nc3c2O1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.31
SPR P35270 1/20 0.31

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
Hydrochloric Acid SCHEMBL5329911 0.87 ALDH1A1 (0.30)
SCHEMBL4575118 0.82 HCRTR1 (0.30) SPR
SCHEMBL5566503 0.78 SPR (0.32) SPR
SCHEMBL5570961 0.76 AKT1 (0.32) SPR
SCHEMBL5328532 0.75 RIPK1 (0.38) SPR
SCHEMBL5323237 0.74 AKT1 (0.35)
SCHEMBL4574346 0.71 HTT (0.34) SPR
SCHEMBL4596912 0.71 LMNA (0.35) GBA1SPR
SCHEMBL4597065 0.71 HCRTR1 (0.33)
SCHEMBL4595427 0.71 LMNA (0.35) SPR

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-2007141253-A1 PROCESS FOR THE PRODUCTION OF INTERMEDIATES FOR THE PREPARATION OF TRICYCLIC IMIDAZOPYRIDINES NYCOMED GMBH (DE) 2007-12-13 WO disclosed