SCHEMBL10446325

SCHEMBL10446325

[CH2]c1cccc(CCc2cccc(-c3ccsc3)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.56
CYP2A6 P11509 3/20 0.44
CYP2B6 P20813 2/20 0.44
CYP2E1 P05181 1/20 0.44
DRD2 P14416 5/20 0.44
DRD4 P21917 3/20 0.44
DRD3 P35462 2/20 0.44
HTR1A P08908 2/20 0.39
KCNH2 Q12809 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
PTPRC P08575 1/20 0.36
CNR1 P21554 1/20 0.36
CTSK P43235 1/20 0.35
CYP17A1 P05093 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35

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
SCHEMBL2465613 0.84 CYP2A6 (0.56) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL13959460 0.81 PRMT6 (0.56) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL9168742 0.81 PRMT6 (0.56) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL14304199 0.80 PRMT6 (0.64) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL3602158 0.80 PRMT6 (0.59) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL9846347 0.80 PRMT6 (0.63) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL10720757 0.77 PRMT6 (0.60) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL9253858 0.77 PRMT6 (0.56) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL9171384 0.77 PRMT6 (0.52) PRMT6CYP2A6CYP2B6CYP2E1DRD2
SCHEMBL9254523 0.76 PRMT6 (0.55) PRMT6CYP2A6CYP2B6CYP2E1DRD2

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
EP-0395768-A1 SUBSTITUTED ALLYLAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE BANYU PHARMACEUTICAL CO., LTD. (JP) 1990-11-07 EP disclosed