SCHEMBL9018151

SCHEMBL9018151

CCCCC(=O)NCCc1ccc(S(=O)(=O)NC(=O)c2ccc(OC(=O)OC)nc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.52
ALDH1A1 P00352 6/20 0.45
POLB P06746 1/20 0.44
STS P08842 2/20 0.43
LMNA P02545 1/20 0.43
P4HTM Q9NXG6 1/20 0.41
CNR1 P21554 1/20 0.41

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
SCHEMBL9018322 0.97 HSD17B10 (0.48) HSD17B10ALDH1A1POLBSTSLMNA
SCHEMBL9018387 0.96 STS (0.48) HSD17B10ALDH1A1POLBSTSCNR1
SCHEMBL9018529 0.96 STS (0.48) HSD17B10ALDH1A1POLBSTSCNR1
SCHEMBL9018243 0.94 ALDH1A1 (0.50) HSD17B10ALDH1A1POLBLMNAP4HTM
SCHEMBL9018453 0.93 HSD17B10 (0.48) HSD17B10ALDH1A1POLBSTSLMNA
SCHEMBL9018451 0.93 HSD17B10 (0.50) HSD17B10ALDH1A1STSLMNA
SCHEMBL9018125 0.92 HSD17B10 (0.48) HSD17B10ALDH1A1POLBSTSLMNA
SCHEMBL9018292 0.91 HSD17B10 (0.48) HSD17B10ALDH1A1POLBSTS
SCHEMBL9018399 0.89 HSD17B10 (0.45) HSD17B10ALDH1A1POLBSTSLMNA
SCHEMBL9018176 0.89 LMNA (0.47) ALDH1A1POLBLMNAP4HTM

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-0590520-B1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AG (DE) 1996-06-12 EP disclosed
EP-0590520-A1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-06 EP disclosed