SCHEMBL14780906

SCHEMBL14780906

CCOC(=O)c1c(CI)c2ccccc2n(Cc2ccc(OC)cc2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FEN1 P39748 1/20 0.54
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ P2RX4 Q99571 1/20 0.53
▸ KDM4E B2RXH2 5/20 0.51
▸ TP53 P04637 1/20 0.50
▸ ALDH1A1 P00352 4/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ GLA P06280 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ CASP1 P29466 1/20 0.49
▸ CASP7 P55210 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ HTT P42858 3/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ P2RX7 Q99572 1/20 0.48

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
SCHEMBL1061448 0.86 L3MBTL1 (0.65) FEN1MEN1KMT2AP2RX4KDM4E
SCHEMBL1063193 0.81 FEN1 (0.51) FEN1MEN1KMT2AP2RX4KDM4E
SCHEMBL14780923 0.78 ALDH1A1 (0.70) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL28312049 0.77 P2RX4 (0.57) FEN1MEN1KMT2AP2RX4KDM4E
SCHEMBL6086588 0.76 ALDH1A1 (0.59) FEN1MEN1KMT2AKDM4EALDH1A1
SCHEMBL12932651 0.76 L3MBTL1 (0.69) MEN1KMT2AP2RX4KDM4ETP53
SCHEMBL1522936 0.76 KDM4E (0.81) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL18582662 0.76 L3MBTL1 (0.71) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL6087197 0.76 ALDH1A1 (0.73) FEN1MEN1KMT2AKDM4EALDH1A1
SCHEMBL2206316 0.75 KMT2A (0.56) FEN1MEN1KMT2AP2RX4KDM4E

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-8399449-B2 Fused heterocyclic derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-03-19 — — US disclosed
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