SCHEMBL8927598

SCHEMBL8927598

CCC(C(=O)c1ccc(Cl)cc1)n1ncn(-c2ccc(N3CCN(c4nccc(OC)n4)CC3)cc2)c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 5/20 0.52
MAPT P10636 3/20 0.47
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
IDO1 P14902 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP3A4 P08684 10/20 0.36
ABCB11 O95342 1/20 0.36
FYN P06241 1/20 0.36
ABCB1 P08183 1/20 0.36
CXCR1 P25024 1/20 0.36
TACR1 P25103 1/20 0.36
MAPK1 P28482 1/20 0.36
AVPR2 P30518 1/20 0.36
CCR4 P51679 1/20 0.36

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
SCHEMBL8926713 0.92 DGAT1 (0.44) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931715 0.87 DGAT1 (0.55) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL9284187 0.84 MAPT (0.55) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931713 0.83 DGAT1 (0.64) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL9287329 0.83 MAPT (0.64) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931707 0.81 MAPT (0.54) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8927528 0.81 DGAT1 (0.64) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931114 0.81 DGAT1 (0.64) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931712 0.81 MAPT (0.54) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931747 0.80 DGAT1 (0.58) DGAT1MAPTLMNAKDM4EALDH1A1

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-5607932-A Heterocyclic derivatives of azolones JANSSEN PHARMACEUTICA N.V. (BE) 1997-03-04 US disclosed