SCHEMBL9522813

SCHEMBL9522813

CCOC(=O)NS(=O)(=O)c1ccccc1OCF

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DRD1 P21728 3/20 0.41
TSHR P16473 3/20 0.41
ALDH1A1 P00352 3/20 0.40
KMT2A Q03164 2/20 0.39
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
GLA P06280 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ATM Q13315 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HTT P42858 2/20 0.37
ACLY P53396 1/20 0.37
MAPT P10636 1/20 0.37
NPC1 O15118 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL10686865 0.83 NR1H4 (0.44) GAATSHRKMT2AATMKDM4E
Benzene SCHEMBL10690567 0.82 KMT2A (0.46) GAASMN1; SMN2TSHRKMT2ACYP2D6
SCHEMBL9789350 0.80 HTT (0.53) GAASMN1; SMN2ALDH1A1ATMKDM4E
SCHEMBL11851628 0.80 GAA (0.49) GAASMN1; SMN2TSHRALDH1A1CYP2D6
SCHEMBL9074960 0.77 TSHR (0.47) GAASMN1; SMN2TSHRALDH1A1KMT2A
SCHEMBL30009742 0.77 HIF1A (0.51) GAAALDH1A1KMT2AMEN1
SCHEMBL9074962 0.76 CA12 (0.58) GAASMN1; SMN2TSHRKMT2ACYP2D6
SCHEMBL9124654 0.75 GAA (0.44) GAASMN1; SMN2TSHRALDH1A1KMT2A
SCHEMBL3834699 0.75 ALDH1A1 (0.57) GAATSHRALDH1A1CYP2D6GLA
SCHEMBL9124659 0.75 GAA (0.44) GAASMN1; SMN2TSHRALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0251079-B1 3-SUBSTITUTED 1-(2-HALOGENOALKOXY-BENZENSULFONYL)-3-HETEROARYLUREA BAYER AG (DE) 1993-05-19 EP claimed
EP-0251079-B1 3-SUBSTITUTED 1-(2-HALOGENOALKOXY-BENZENSULFONYL)-3-HETEROARYLUREA BAYER AG (DE) 1993-05-19 EP disclosed