SCHEMBL4397593

SCHEMBL4397593

CSc1ccc(S(=O)(=O)N2CCC(N3C(=O)OCc4cccc(Cl)c43)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.53
TSHR P16473 1/20 0.44
CCR1 P32246 1/20 0.43
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
PKM P14618 3/20 0.42
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40

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
SCHEMBL3156820 0.82 HTR6 (0.68) HTR6PKM
SCHEMBL3148482 0.80 HTR6 (0.70) HTR6
SCHEMBL14093833 0.79 HTR6 (0.69) HTR6TSHRMEN1KMT2A
SCHEMBL3143762 0.79 HTR6 (0.69) HTR6TSHRMEN1KMT2A
SCHEMBL3148210 0.79 HTR6 (0.74) HTR6
SCHEMBL3153469 0.78 HTR6 (0.66) HTR6
SCHEMBL3147482 0.78 HTR6 (0.66) HTR6
SCHEMBL3147199 0.78 HTR6 (0.68) HTR6TSHRMEN1KMT2A
SCHEMBL3143119 0.78 HTR6 (0.68) HTR6TSHRMEN1KMT2A
SCHEMBL3153497 0.78 HTR6 (0.70) HTR6CCR1

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-1648886-B1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR (ES) 2009-12-09 EP claimed