SCHEMBL6559192

SCHEMBL6559192

CCS(=O)(=O)NC1CC(C)(C)Oc2ccc(-c3ccc(Br)cc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 7/20 0.37
KCNA5 P22460 2/20 0.35
SIRT2 Q8IXJ6 3/20 0.34
HTR2B P41595 2/20 0.33
HTR1A P08908 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
KIF11 P52732 1/20 0.33
CTSD P07339 3/20 0.33
BACE1 P56817 3/20 0.33
BACE2 Q9Y5Z0 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
IDO1 P14902 1/20 0.32
SIRT1 Q96EB6 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
SCHEMBL6560799 0.91 HTR2B (0.42) TRPV1KCNA5SIRT2HTR2BHTR1A
SCHEMBL6558641 0.83 TRPV1 (0.39) TRPV1KCNA5SIRT2HTR2BHTR1A
SCHEMBL6559589 0.82 TRPV1 (0.52) TRPV1
SCHEMBL6560806 0.82 KCNA5 (0.44) TRPV1KCNA5SIRT2CTSDBACE1
SCHEMBL6559382 0.80 MAPT (0.45) TRPV1KCNA5SIRT2HTR2BHTR1A
SCHEMBL6559509 0.80 TRPV1 (0.45) TRPV1KCNA5
SCHEMBL6560445 0.79 KCNA5 (0.44) TRPV1KCNA5SIRT2CTSDBACE1
SCHEMBL6560790 0.79 SIRT2 (0.44) TRPV1KCNA5SIRT2
SCHEMBL6559918 0.78 TRPV1 (0.38) TRPV1KCNA5SIRT2CTSDBACE1
SCHEMBL6560820 0.78 KCNA5 (0.36) TRPV1KCNA5SIRT2

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