SCHEMBL7458450

SCHEMBL7458450

Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2ncccc2C(O)C(C)F)n1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.41
GAA P10253 4/20 0.40
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 2/20 0.37
LMNA P02545 2/20 0.37
TP53 P04637 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
NLRP3 Q96P20 2/20 0.36
MEN1 O00255 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RXFP1 Q9HBX9 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
SCHEMBL7452294 0.92 GAA (0.47) ALOX15GAATSHRTP53SMN1; SMN2
SCHEMBL9267498 0.87 GAA (0.53) GAAKMT2ATP53NLRP3MEN1
SCHEMBL7455445 0.85 ALOX15 (0.43) ALOX15GAAALDH1A1TSHRKMT2A
SCHEMBL9276129 0.84 MAPT (0.37) ALOX15GAAALDH1A1TP53SMN1; SMN2
SCHEMBL7455217 0.84 GAA (0.47) GAAALDH1A1TP53SMN1; SMN2NPC1
SCHEMBL7455302 0.83 ALOX15 (0.41) ALOX15GAAALDH1A1TSHRKMT2A
SCHEMBL9262034 0.82 GAA (0.45) ALOX15GAATSHRTP53SMN1; SMN2
SCHEMBL9216687 0.82 ALDH1A1 (0.39) GAAALDH1A1TP53SMN1; SMN2NPC1
SCHEMBL9264502 0.81 GAA (0.45) ALOX15GAATSHRTP53SMN1; SMN2
SCHEMBL10999321 0.79 ALOX15 (0.46) ALOX15GAAALDH1A1TSHRKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0639190-B1 PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD (KR) 2002-01-09 EP claimed
US-5461026-A Pyridine sulfonyl urea derivatives KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-10-24 US claimed
WO-1992014728-A1 PYRIDINE SULFONYL UREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-09-03 WO claimed
EP-0639190-B1 PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD (KR) 2002-01-09 EP disclosed