SCHEMBL4739249

SCHEMBL4739249

CON(C)C(=O)c1cc2c(nc(C)n2C)c2c1CCC1(CCc3ccccc31)O2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 3/20 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
SCHEMBL4735029 0.91 NPY5R (0.33)
SCHEMBL4739107 0.88 ALDH1A1 (0.31)
SCHEMBL4740444 0.87 HCAR2 (0.34) PIN1
SCHEMBL4734328 0.86 CCNC (0.32) PIN1
SCHEMBL4737642 0.84 NPY5R (0.37)
SCHEMBL4784972 0.84 NPY5R (0.33)
SCHEMBL4736353 0.83 HRH3 (0.32)
SCHEMBL4738895 0.83 KMT2A (0.36)
SCHEMBL4738952 0.82
SCHEMBL4737352 0.82 LMNA (0.33)

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-2008071765-A1 PHARMACEUTICALLY ACTIVE SPIRO-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES NYCOMED GMBH (DE) 2008-06-19 WO claimed