SCHEMBL6559544

SCHEMBL6559544

CCS(=O)(=O)N(Cc1ccncc1)C1CC(C)(C)Oc2ccc(C(=O)O)cc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 5/20 0.36
ALDH1A1 P00352 2/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TRPM8 Q7Z2W7 2/20 0.34
KCNE1 P15382 5/20 0.32
KCNQ1 P51787 5/20 0.32
TBXAS1 P24557 3/20 0.32
TBXA2R P21731 1/20 0.32

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
SCHEMBL6559500 0.87 NPSR1 (0.38) KCNA5SMN1; SMN2NPSR1KCNE1KCNQ1
SCHEMBL6559927 0.83 KCNA5 (0.41) KCNA5ALDH1A1KCNE1KCNQ1TBXAS1
SCHEMBL6558561 0.82 KCNE1 (0.34) KCNA5NPSR1KCNE1KCNQ1TBXAS1
SCHEMBL6558501 0.82 KCNE1 (0.45) KCNA5KCNE1KCNQ1TBXAS1TBXA2R
SCHEMBL7826231 0.79 KCNE1 (0.36) KCNA5KCNE1KCNQ1TBXAS1TBXA2R
SCHEMBL6559913 0.77 TDP1 (0.38) KCNA5ALDH1A1PKMHTTRECQL
SCHEMBL6559607 0.77 KCNE1 (0.47) KCNA5KCNE1KCNQ1TBXAS1TBXA2R
SCHEMBL6559205 0.76 SMN1; SMN2 (0.38) KCNA5ALDH1A1HTTSMN1; SMN2NPSR1
SCHEMBL6560005 0.75 KCNE1 (0.43) KCNA5ALDH1A1KCNE1KCNQ1TBXAS1
SCHEMBL6559550 0.74 MEN1 (0.37) KCNA5ALDH1A1KCNE1KCNQ1TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP disclosed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed