SCHEMBL6560005

SCHEMBL6560005

CN(C1CC(C)(C)Oc2ccc(C(=O)O)cc21)S(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 10/20 0.43
KCNQ1 P51787 10/20 0.43
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
TBXA2R P21731 1/20 0.36
TBXAS1 P24557 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
KCNH2 Q12809 1/20 0.35
RXRA P19793 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
KCNA5 P22460 1/20 0.34

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
SCHEMBL6560808 0.91 KCNE1 (0.41) KCNE1KCNQ1KCNH2TRPV1
SCHEMBL6559550 0.89 MEN1 (0.37) KCNE1KCNQ1MEN1KMT2ATDP1
SCHEMBL6559277 0.89 KCNE1 (0.40) KCNE1KCNQ1MEN1KMT2AALDH1A1
SCHEMBL6558501 0.88 KCNE1 (0.45) KCNE1KCNQ1MEN1KMT2ATBXA2R
SCHEMBL6559508 0.87 MEN1 (0.35) KCNE1KCNQ1MEN1KMT2ATDP1
SCHEMBL6602008 0.85 KCNE1 (0.44) KCNE1KCNQ1MEN1KMT2AALDH1A1
SCHEMBL6559607 0.83 KCNE1 (0.47) KCNE1KCNQ1MEN1KMT2ATBXA2R
SCHEMBL6559500 0.82 NPSR1 (0.38) KCNE1KCNQ1MEN1KMT2ATDP1
SCHEMBL6558778 0.80 HTR1A (0.36) KCNE1KCNQ1KCNA5
SCHEMBL6559947 0.80 KCNE1 (0.51) KCNE1KCNQ1MEN1KMT2A

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