SCHEMBL9259713

SCHEMBL9259713

CC(O)COc1cccc(-c2ccsc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
PRMT6 Q96LA8 1/20 0.44
HTR1A P08908 1/20 0.41
CYP2E1 P05181 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2B6 P20813 1/20 0.40
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
GAK O14976 1/20 0.38
PDGFRB P09619 2/20 0.37
PDGFRA P16234 2/20 0.37
PRMT5 O14744 2/20 0.37
WDR77 Q9BQA1 2/20 0.37
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
P2RX3 P56373 1/20 0.37
MC4R P32245 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
SCHEMBL9254650 0.82 HTR1A (0.40) PRMT6HTR1ACYP2E1CYP2A6CYP2B6
SCHEMBL30963937 0.80 RXRA (0.51) PRMT6CYP2E1CYP2A6CYP2B6GAK
SCHEMBL9256741 0.80 LMNA (0.40) LMNAPRMT6HSD17B1HSD17B2
SCHEMBL9257607 0.79 ALDH1A1 (0.47) PRMT6HTR1ACYP2E1CYP2A6CYP2B6
SCHEMBL1241813 0.78 LMNA (0.73) LMNATSHRMAPK1HIF1AADRB2
SCHEMBL9255957 0.78 HTR1A (0.40) PRMT6HTR1ACYP2E1CYP2A6CYP2B6
SCHEMBL9256522 0.77 PRMT6 (0.48) LMNAPRMT6HTR1ACYP2E1CYP2A6
SCHEMBL12251044 0.77 PRMT6 (0.47) PRMT6HTR1ACYP2E1CYP2A6CYP2B6
SCHEMBL27337600 0.76 LMNA (0.55) LMNATSHRADRB2ADRB1
SCHEMBL9261099 0.75 LMNA (0.53) LMNACYP2E1CYP2A6CYP2B6MAPK1

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
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