SCHEMBL4667200

SCHEMBL4667200

Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(C(Cc2ccccc2F)c2nc3c([nH]2)c(=O)[nH]c(=O)n3CC2CCC2)nc1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PCK1 P35558 16/20 0.55
SGK1 O00141 3/20 0.33
KMT2A Q03164 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
SCHEMBL4615614 0.89 PCK1 (0.56) PCK1SGK1KMT2A
SCHEMBL4615362 0.89 PCK1 (0.60) PCK1SGK1
SCHEMBL4613421 0.86 PCK1 (0.55) PCK1
SCHEMBL6277795 0.80 PCK1 (0.60) PCK1SGK1KMT2A
SCHEMBL4614369 0.79 PCK1 (0.47) PCK1
SCHEMBL4615633 0.76 PCK1 (0.59) PCK1
SCHEMBL4615659 0.76 PCK1 (0.59) PCK1KMT2A
SCHEMBL4612921 0.74 PCK1 (0.58) PCK1
SCHEMBL4614243 0.74 PCK1 (0.53) PCK1
SCHEMBL4614233 0.74 PCK1 (0.47) PCK1KMT2A

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
EP-1599477-B1 SULFONAMIDE SUBSTITUTED XANTHINE DERIVATIVES FOR USE AS PEPCK INHIBITORS HOFFMANN LA ROCHE (CH) 2008-01-30 EP claimed