SCHEMBL27411545

SCHEMBL27411545

Nc1cc(O)c(CN2N=C(c3ccc(Cl)c(Cl)c3)NC2C=O)cc1Cl

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 1/20 0.31
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
EGFR P00533 1/20 0.30
ERBB2 P04626 1/20 0.30

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
SCHEMBL27410045 0.87 ALOX5AP (0.33)
SCHEMBL27411547 0.71 P2RX1 (0.38) MEN1HTTKMT2A
SCHEMBL5754313 0.68 MEN1 (0.37) RPS6KB1MEN1HTTKMT2A
SCHEMBL7943945 0.66 KMT2A (0.39) RPS6KB1MEN1HTTKMT2A
SCHEMBL8102083 0.58 GAA (0.44)
SCHEMBL5843666 0.55 CYP3A4 (0.71) MEN1HTTKMT2A
SCHEMBL9630036 0.54 AHR (0.70) MEN1KMT2A
SCHEMBL27914994 0.52 NISCH (0.34) KMT2A
SCHEMBL28766936 0.51 TYR (0.49) MEN1HTTKMT2A
SCHEMBL7906570 0.51 AHR (0.70) MEN1HTTKMT2A

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
CN-1226803-A Diphenyl heterocycles as potassium channel modulators BRISTOL MYERS SQUIBB CO (US) 1999-08-25 CN claimed
CN-1116287-C Diphenyl heterocycles as potassium channel modulators BRISTOL MYERS SQUIBB CO (US) 2003-07-30 CN disclosed
CN-1226803-A Diphenyl heterocycles as potassium channel modulators BRISTOL MYERS SQUIBB CO (US) 1999-08-25 CN disclosed