SCHEMBL4394298

SCHEMBL4394298

Cc1cnc2ccc(S(=O)(=O)N3CCC(N4C(=O)OCc5cc(F)ccc54)CC3)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.44
LMNA P02545 4/20 0.41
MAPT P10636 3/20 0.41
PKM P14618 2/20 0.41
MAPK10 P53779 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.40
TSHR P16473 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TP53 P04637 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
HSD17B10 Q99714 1/20 0.37
IDH1 O75874 1/20 0.36
OXTR P30559 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
SCHEMBL4398501 0.92 HTR6 (0.46) HTR6LMNAMAPTALDH1A1HTT
SCHEMBL4397615 0.90 HTR6 (0.49) HTR6LMNAMAPTUSP2ALDH1A1
SCHEMBL4399061 0.89 HTR6 (0.56) HTR6LMNAOXTR
SCHEMBL4402141 0.86 HTR6 (0.56) HTR6LMNAMAPTPKMMAPK10
SCHEMBL3146725 0.83 HTR6 (0.61) HTR6ALDH1A1OXTR
SCHEMBL4399483 0.82 HTR6 (0.61) HTR6LMNAMAPTALDH1A1HTT
SCHEMBL3147668 0.82 HTR6 (0.56) HTR6LMNAMAPTPKMKDM4E
SCHEMBL4392195 0.82 HTR6 (0.44) HTR6LMNAMAPTUSP2ALDH1A1
SCHEMBL4394478 0.81 HTR6 (0.56) HTR6LMNAMAPTALDH1A1HTT
SCHEMBL4390344 0.81 HTR6 (0.55) HTR6LMNAMAPTKMT2AMEN1

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