SCHEMBL9258741

SCHEMBL9258741

COC(C)OC.O=CCCOc1cccc(-c2ccsc2)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.41
PRMT6 Q96LA8 1/20 0.40
P2RX3 P56373 1/20 0.39
ERN1 O75460 2/20 0.37
KDR P35968 1/20 0.37
MC4R P32245 1/20 0.37
PPARD Q03181 1/20 0.35
CTSK P43235 1/20 0.35
PDGFRB P09619 2/20 0.34
PDGFRA P16234 2/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
LTB4R Q15722 2/20 0.34
LTA4H P09960 1/20 0.34
CTSA P10619 1/20 0.34

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
SCHEMBL9259547 0.90 PRMT6 (0.44) HTR1APRMT6ERN1KDRMC4R
SCHEMBL9258748 0.78 PRMT6 (0.43) HTR1APRMT6P2RX3KDRMC4R
SCHEMBL9253601 0.77 PRMT6 (0.43) HTR1APRMT6ERN1KDRPPARD
SCHEMBL9174629 0.77 PRMT6 (0.39) HTR1APRMT6P2RX3ERN1KDR
SCHEMBL9259713 0.75 LMNA (0.50) HTR1APRMT6P2RX3MC4RPDGFRB
SCHEMBL9254796 0.74 PRMT6 (0.39) HTR1APRMT6ERN1KDRMC4R
SCHEMBL9254793 0.74 PRMT6 (0.39) HTR1APRMT6ERN1KDRMC4R
SCHEMBL9257607 0.74 ALDH1A1 (0.47) HTR1APRMT6KDRPPARDPDGFRB
SCHEMBL9258896 0.74 LTB4R (0.41) MC4RPPARDLTB4R
SCHEMBL9258901 0.74 LTB4R (0.41) MC4RPPARDLTB4R

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-5439932-A Anticholesterol agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-08-08 US disclosed