SCHEMBL8869191

SCHEMBL8869191

COC(=O)CNC(=O)c1ccc(C(=O)NS(=O)(=O)c2cccc(CCNC(=O)c3ccc(Cl)cc3)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
NAMPT P43490 1/20 0.45
GAA P10253 2/20 0.45
HIF1A Q16665 1/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA7 P43166 3/20 0.44
CA9 Q16790 3/20 0.44
CA14 Q9ULX7 3/20 0.44
P4HTM Q9NXG6 2/20 0.43
EGFR P00533 1/20 0.43
CXCR3 P49682 1/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
TRPV1 Q8NER1 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL8869834 0.94 P4HTM (0.48) PPARASMN1; SMN2ALDH1A1LMNAHIF1A
SCHEMBL8867299 0.92 CA1 (0.43) PPARASMN1; SMN2ALDH1A1LMNANAMPT
SCHEMBL8869533 0.92 PPARA (0.49) PPARASMN1; SMN2ALDH1A1LMNAGAA
SCHEMBL8868797 0.91 SMN1; SMN2 (0.49) PPARASMN1; SMN2ALDH1A1LMNANAMPT
SCHEMBL8868856 0.91 CA1 (0.51) PPARASMN1; SMN2ALDH1A1LMNACA1
SCHEMBL8869629 0.91 P4HTM (0.45) PPARASMN1; SMN2ALDH1A1LMNAHIF1A
SCHEMBL8867910 0.90 NLRP3 (0.54) SMN1; SMN2ALDH1A1LMNANAMPTHIF1A
SCHEMBL8869698 0.90 PPARA (0.53) PPARASMN1; SMN2ALDH1A1LMNANAMPT
SCHEMBL8869066 0.90 PPARA (0.53) PPARASMN1; SMN2ALDH1A1LMNANAMPT
SCHEMBL8868570 0.89 HIF1A (0.48) PPARASMN1; SMN2ALDH1A1LMNANAMPT

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
US-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed