SCHEMBL9269029

SCHEMBL9269029

CN(C(=S)c1c(O)c2cc(Cl)ccc2n(C)c1=O)c1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ PGR P06401 1/20 0.46
▸ GSK3B P49841 3/20 0.45
▸ ALDH1A1 P00352 5/20 0.43
▸ HIF1A Q16665 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HTR3E A5X5Y0 1/20 0.39
▸ HTR3B O95264 1/20 0.39
▸ HTR3A P46098 1/20 0.39
▸ HTR3D Q70Z44 1/20 0.39
▸ HTR3C Q8WXA8 1/20 0.39
▸ HTR1A P08908 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ HTR7 P34969 1/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ EGFR P00533 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
SCHEMBL8085817 0.92 MEN1 (0.56) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL8086963 0.84 GSK3B (0.43) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9279359 0.83 MEN1 (0.56) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9287554 0.81 GSK3B (0.41) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9270493 0.81 MEN1 (0.43) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9270246 0.81 MEN1 (0.47) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9287071 0.80 ALDH1A1 (0.42) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL10674315 0.80 MEN1 (0.74) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9282960 0.79 GSK3B (0.43) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9201791 0.77 KMT2A (0.54) MEN1KMT2APGRALDH1A1HIF1A

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-1995024395-A1 QUINOLINE DERIVATIVES AS IMMUNOMODULATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-14 — — WO disclosed
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