SCHEMBL19914570

SCHEMBL19914570

CNCCCCOCCN(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 1/20 0.48
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
PRMT1 Q99873 1/20 0.48
PRMT8 Q9NR22 1/20 0.48
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
USP2 O75604 1/20 0.36
EPHX1 P07099 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.33
SLC6A4 P31645 1/20 0.33
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 2/20 0.32
L3MBTL4 Q8NA19 1/20 0.32
L3MBTL3 Q96JM7 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL15003875 0.93 PRMT3 (0.50) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL14579618 0.87 PRMT3 (0.48) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL12397048 0.84 PRMT3 (0.50) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL737040 0.84 PRMT3 (0.55) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL25479588 0.83 PRMT3 (0.44) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL15441814 0.83 EPHX1 (0.48) EPHX1L3MBTL1SLC6A4CYP2C9TSHR
SCHEMBL14579613 0.83 PRMT3 (0.48) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL16381873 0.82 PRMT3 (0.52) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL12397038 0.82 PRMT3 (0.52) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL7621262 0.81 ALDH1A1 (0.47) CA12CA1CA2CA9USP2

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
WO-2018039621-A1 INHIBITION OF OLIG2 ACTIVITY Curtana Pharmaceuticals, Inc. (US) 2018-03-01 WO disclosed