SCHEMBL6002292

SCHEMBL6002292

O=C(O)Oc1cc2cc(NS(=O)(=O)C(F)(F)F)ccc2n1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 4/20 0.48
CCR2 P41597 1/20 0.43
ECE1 P42892 2/20 0.39
PPARG P37231 5/20 0.39

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
SCHEMBL6002268 0.86 MAPK1 (0.38) SERPINE1CCR2ECE1
SCHEMBL6001762 0.84 SERPINE1 (0.67) SERPINE1CCR2
SCHEMBL6002238 0.81 CACNA1B (0.40) SERPINE1ECE1
SCHEMBL6001817 0.80 MAPK1 (0.43)
SCHEMBL6002233 0.80 ECE1 (0.43) ECE1PPARG
SCHEMBL9666902 0.75 CCR2 (0.61) CCR2
SCHEMBL6002334 0.75 SMN1; SMN2 (0.39) SERPINE1ECE1
SCHEMBL8697469 0.73 CCR2 (0.63) SERPINE1CCR2PPARG
SCHEMBL6001828 0.73 SMN1; SMN2 (0.43) ECE1
SCHEMBL7076317 0.72 PPARG (0.48) CCR2PPARG

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-1212296-B9 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN INC (US) 2006-05-10 EP claimed
EP-1212296-B1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN INC (US) 2005-11-09 EP claimed