SCHEMBL6559963

SCHEMBL6559963

CCS(=O)(=O)NC1CCOc2ccc(F)cc21

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.42
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
CTSD P07339 1/20 0.37
BACE1 P56817 1/20 0.37
PKM P14618 1/20 0.36
HTR2A P28223 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL31595501 0.81 TRPV1 (0.45) TRPV1CTSDBACE1HTR2A
SCHEMBL12927161 0.79 TRPV1 (0.44) TRPV1CTSDBACE1DRD3
SCHEMBL6559589 0.77 TRPV1 (0.52) TRPV1
SCHEMBL6559512 0.74 TRPV1 (0.52) TRPV1
SCHEMBL6937196 0.74 TRPV1 (0.47) TRPV1CYP11B1CYP11B2
SCHEMBL6344681 0.74 DRD2 (0.44) CYP11B1CYP11B2HTR2ADRD3
SCHEMBL6340312 0.74 CYP11B1 (0.40) CYP11B1CYP11B2CTSDBACE1HTR2A
SCHEMBL6560802 0.73 TRPV1 (0.51) TRPV1CTSDBACE1
SCHEMBL10883982 0.73 TRPV1 (0.53) TRPV1CTSDBACE1
SCHEMBL7857620 0.73 ENPP2 (0.41) TRPV1CTSDBACE1HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1204134-C Sulfamine-substituted benzodihydopyran, preparation method, use as medicine or diagnostic reagent and medicine containing same HOECHST AG (DE) 2005-06-01 CN disclosed
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
CN-1169429-A Sulfamine-substituted benzodihydopyran, preparation method, use as medicine or diagnostic reagent and medicine containing same HOECHST AG (DE) 1998-01-07 CN 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