SCHEMBL4399484

SCHEMBL4399484

Cc1ccc2c(c1)COC(=O)N2C1CCN(S(=O)(=O)c2ccc(C)c(O)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.46
MAPT P10636 2/20 0.42
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CREBBP Q92793 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
SCHEMBL3153162 0.91 HTR6 (0.48) HTR6MAPTKMT2AALDH1A1USP2
SCHEMBL4392276 0.89 HTR6 (0.59) HTR6
SCHEMBL3142474 0.89 HTR6 (0.52) HTR6KMT2AALDH1A1
SCHEMBL3155997 0.86 HTR6 (0.46) HTR6MAPTALDH1A1HTT
SCHEMBL3152980 0.86 HTR6 (0.50) HTR6ALDH1A1
SCHEMBL3156877 0.86 HTR6 (0.54) HTR6KMT2AALDH1A1USP2LMNA
SCHEMBL3152816 0.86 HTR6 (0.49) HTR6ALDH1A1
SCHEMBL3156964 0.85 HTR6 (0.49) HTR6
SCHEMBL3138639 0.85 HTR6 (0.47) HTR6MAPTALDH1A1TSHRHTT
SCHEMBL3153657 0.85 HTR6 (0.55) HTR6ALDH1A1LMNAHTTSMN1; SMN2

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