SCHEMBL9430879

SCHEMBL9430879

Cc1ccc2oc(CNCc3cccc(Cl)c3)c(-c3ccc(Cl)cc3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
PTPN1 P18031 1/20 0.41
MAPT P10636 4/20 0.40
CXCR4 P61073 2/20 0.40
TP53 P04637 2/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
CSNK2A1 P68400 1/20 0.40
CHRM2 P08172 1/20 0.39
ANO1 Q5XXA6 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
ATM Q13315 1/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HDAC1 Q13547 1/20 0.36
NPC1 O15118 1/20 0.36
IGF1R P08069 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
SCHEMBL9431173 0.97 L3MBTL1 (0.43) L3MBTL1PTPN1MAPTCXCR4TP53
SCHEMBL9431302 0.91 L3MBTL1 (0.49) L3MBTL1PTPN1MAPTTP53CSNK2A2
SCHEMBL9215410 0.90 L3MBTL1 (0.40) L3MBTL1PTPN1MAPTCXCR4TP53
Hydrochloric Acid SCHEMBL9213805 0.90 L3MBTL1 (0.48) L3MBTL1PTPN1MAPTTP53CSNK2A2
SCHEMBL9431764 0.89 L3MBTL1 (0.43) L3MBTL1PTPN1MAPTTP53CSNK2A2
Hydrochloric Acid SCHEMBL9216724 0.87 L3MBTL1 (0.42) L3MBTL1PTPN1MAPTTP53CSNK2A2
Hydrochloric Acid SCHEMBL9219672 0.86 L3MBTL1 (0.39) L3MBTL1PTPN1MAPTCXCR4TP53
Hydrochloric Acid SCHEMBL9220707 0.85 L3MBTL1 (0.43) L3MBTL1PTPN1MAPTTP53ANO1
SCHEMBL9217698 0.84 L3MBTL1 (0.40) L3MBTL1PTPN1MAPTTP53CSNK2A2
SCHEMBL9221219 0.83 CA1 (0.43) PTPN1MEN1KMT2A

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-1994026738-A1 N'-HETEROCYCLYL-N-BENZOFURANYL UREA DERIVATIVES AND THEIR ANALOGS AS ACAT INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 WO disclosed