SCHEMBL7417140

SCHEMBL7417140

NCc1cccnc1S(=O)(=O)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 14/20 0.43
ALOX5AP P20292 13/20 0.43
LOXL2 Q9Y4K0 2/20 0.37
COMT P21964 1/20 0.37
DPP4 P27487 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL28064708 0.78 FEN1 (0.49) FEN1ALOX5APCOMTKMT2A
SCHEMBL17372075 0.78 DPP4 (0.41) LOXL2DPP4KMT2A
SCHEMBL7416470 0.76 KMT2A (0.42) LOXL2DPP4KMT2A
SCHEMBL7418680 0.75 KMT2A (0.41) LOXL2COMTDPP4KMT2A
SCHEMBL15916605 0.75 TDP1 (0.44) FEN1ALOX5APCOMT
SCHEMBL4793133 0.74 KMT2A (0.39) FEN1ALOX5APLOXL2COMTDPP4
SCHEMBL9955204 0.73 PARP1 (0.45) FEN1ALOX5APCOMTKMT2A
SCHEMBL7533479 0.73 DPP4 (0.36) LOXL2DPP4KMT2A
SCHEMBL8233996 0.73 CTSB (0.45) FEN1ALOX5APLOXL2DPP4
SCHEMBL7423716 0.72 DPP4 (0.37) FEN1ALOX5APLOXL2DPP4KMT2A

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-1255735-A2 PYRIDINE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2002-11-13 EP claimed
WO-2001056990-A2 PYRIDINE DERIVATES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2001-08-09 WO claimed