SCHEMBL11468753

SCHEMBL11468753

CC(=O)Nc1ccc(S(=O)(=O)CCN2CCOCC2)cc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.65
L3MBTL1 Q9Y468 1/20 0.64
KMT2A Q03164 3/20 0.62
MEN1 O00255 1/20 0.62
CA1 P00915 4/20 0.57
CA2 P00918 4/20 0.57
CA9 Q16790 4/20 0.57
POLB P06746 3/20 0.57
ALDH1A1 P00352 3/20 0.56
MAPT P10636 1/20 0.56
CYP3A4 P08684 1/20 0.55
HTT P42858 1/20 0.55
KDM4E B2RXH2 3/20 0.55
GLA P06280 1/20 0.52
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL11468956 0.92 EPHX2 (0.77) EPHX2L3MBTL1KMT2AMEN1CA1
SCHEMBL10846755 0.84 EPHX2 (0.69) EPHX2L3MBTL1KMT2ACA1CA2
SCHEMBL9885410 0.82 POLB (0.75) EPHX2L3MBTL1KMT2AMEN1POLB
SCHEMBL11468670 0.81 MEN1 (0.60) EPHX2KMT2AMEN1CA1CA2
SCHEMBL11531653 0.80 MEN1 (0.72) EPHX2KMT2AMEN1POLBALDH1A1
SCHEMBL2920100 0.80 MEN1 (0.72) EPHX2KMT2AMEN1CA1CA2
SCHEMBL11526865 0.80 KMT2A (0.63) EPHX2KMT2AMEN1POLBALDH1A1
SCHEMBL28069120 0.80 KDM4E (0.59) EPHX2L3MBTL1KMT2AALDH1A1MAPT
SCHEMBL23747762 0.79 CNR1 (0.62) EPHX2KMT2APOLBALDH1A1MAPT
SCHEMBL11534382 0.78 MEN1 (0.65) EPHX2L3MBTL1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4183927-A Substituted phenylthioalkylamines and compositions thereof THE DOW CHEMICAL COMPANY (US) 1980-01-15 US disclosed
US-4155907-A Method for inhibiting ADP-induced platelet aggregation using phenylthioalkylamines THE DOW CHEMICAL COMPANY (US) 1979-05-22 US disclosed
US-4141983-A Method for inhibiting ADP-induced platelet aggregation using phenylthioalkylamines THE DOW CHEMICAL COMPANY (US) 1979-02-27 US disclosed
US-4134996-A METHOD FOR INHIBITING ADP-INDUCED PLATELET AGGREGATION USING PHENYLTHIOALKYLAMINES THE DOW CHEMICAL COMPANY (US) 1979-01-16 US disclosed