SCHEMBL8544819

SCHEMBL8544819

O=C(O)CCc1c[nH]c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc12

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 12/20 0.59
HPGD P15428 1/20 0.52
CYP2C19 P33261 1/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
BRD4 O60885 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL8539413 0.89 HTR6 (0.56) HTR6MEN1KMT2A
SCHEMBL4169893 0.83 BRD4 (0.53) HTR6PTGDR2BRD4GAAMAPT
SCHEMBL9370964 0.82 SPR (0.64) HTR6HPGDCYP2C19MAPT
SCHEMBL4350200 0.81 HPGD (0.57) HTR6HPGDCYP2C19
SCHEMBL892530 0.80 HPGD (0.69) HPGDCYP2C19
SCHEMBL8539181 0.78 HTR6 (0.56) HTR6MEN1KMT2AMAPT
SCHEMBL8544817 0.78 GAA (0.53) PTGDR2MEN1KMT2ABRD4GAA
SCHEMBL4160229 0.78 BRD4 (0.46) HTR6BRD4GAAMAPT
SCHEMBL3961886 0.75 HTR6 (0.76) HTR6
SCHEMBL3297282 0.75 HTR6 (0.76) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0715627-B1 INDOLE DERIVATIVES AS THROMBOXANE A2 ANTAGONISTS PFIZER LTD (GB) 1998-09-09 EP claimed