SCHEMBL6300788

SCHEMBL6300788

CC(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 15/20 0.77
MEN1 O00255 2/20 0.77
KMT2A Q03164 2/20 0.77
MAPT P10636 1/20 0.68
CXCR3 P49682 2/20 0.66
PTGES O14684 2/20 0.65
TAS2R8 Q9NYW2 1/20 0.65
ALDH1A1 P00352 1/20 0.64
PKM P14618 1/20 0.64
HTT P42858 1/20 0.64
RECQL P46063 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
HSD17B10 Q99714 1/20 0.64
POLB P06746 1/20 0.62

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
SCHEMBL5010683 0.89 HTR2A (0.70) TAS2R14MEN1KMT2AMAPTCXCR3
SCHEMBL1278616 0.87 TAS2R14 (1.00) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL1278788 0.86 TAS2R14 (0.97) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL6976163 0.84 TAS2R14 (0.77) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL6300786 0.84 TAS2R14 (0.77) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL24724004 0.82 TAS2R14 (0.80) TAS2R14CXCR3PTGESTAS2R8
SCHEMBL1279497 0.82 TAS2R14 (1.00) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL1279183 0.82 TAS2R14 (1.00) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL3814018 0.82 TAS2R14 (0.73) TAS2R14MEN1KMT2ACXCR3PTGES
SCHEMBL984791 0.81 TAS2R14 (0.71) TAS2R14MEN1KMT2AMAPTCXCR3

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
US-6869968-B1 Such as 3-(4-fluorophenyl)-4-(4-methysulphonylphenyl)-2-(3H)-oxazolone; for treating colorectal cancer, fevers, and inflammation ALLMIRALL PRODESFARMA S.A. (ES) 2005-03-22 US disclosed