SCHEMBL9257846

SCHEMBL9257846

CC(=O)/C=C/c1cccc(-c2ccsc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
IAPP P10997 1/20 0.44
PTGS1 P23219 1/20 0.44
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
PRMT6 Q96LA8 1/20 0.42
CNR1 P21554 1/20 0.42
CYP2E1 P05181 1/20 0.41
CYP2A6 P11509 1/20 0.41
CYP2B6 P20813 1/20 0.41
ACMSD Q8TDX5 1/20 0.40
ERN1 O75460 1/20 0.40
RELA Q04206 1/20 0.39
APP P05067 1/20 0.39
KAT6A Q92794 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
PLAAT3 P53816 1/20 0.38
PLAAT5 Q96KN8 1/20 0.38

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
SCHEMBL9257850 1.00 GLA (0.49) GLATDP1IAPPPTGS1HDAC2
SCHEMBL9254831 0.87 NPSR1 (0.51) GLATDP1HDAC2HDAC8CNR1
SCHEMBL9254826 0.87 NPSR1 (0.51) GLATDP1HDAC2HDAC8CNR1
SCHEMBL9454450 0.85 CNR1 (0.45) HDAC2HDAC8PRMT6CNR1CYP2E1
SCHEMBL9454454 0.85 CNR1 (0.45) HDAC2HDAC8PRMT6CNR1CYP2E1
SCHEMBL23289049 0.77 HDAC2 (0.68) GLATDP1IAPPPTGS1HDAC2
SCHEMBL9175193 0.77 ERN1 (0.46) PRMT6CNR1CYP2E1CYP2A6CYP2B6
SCHEMBL9259298 0.77 CCNB2 (0.49) PRMT6CNR1CYP2E1CYP2A6CYP2B6
SCHEMBL9259305 0.77 CCNB2 (0.49) PRMT6CNR1CYP2E1CYP2A6CYP2B6
SCHEMBL9175181 0.77 ERN1 (0.46) PRMT6CNR1CYP2E1CYP2A6CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5439932-A Anticholesterol agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-08-08 US disclosed
US-5306728-A Substituted amine derivatives having antihyperlipemia activity BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-04-26 US disclosed
EP-0448078-A2 Substituted amine derivatives having anti-hyperlipemia activity BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-09-25 EP disclosed