SCHEMBL9587376

SCHEMBL9587376

CSc1ccc(Oc2ccc(CNC(=O)c3cc(C)n(C)n3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ BAZ2B Q9UIF8 1/20 0.45
▸ CHRM4 P08173 2/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ HPGD P15428 3/20 0.44
▸ MAPT P10636 1/20 0.44
▸ EPHX2 P34913 1/20 0.44
▸ NR1H4 Q96RI1 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ MAPK14 Q16539 2/20 0.43
▸ MLLT3 P42568 1/20 0.43
▸ MLLT1 Q03111 1/20 0.43
▸ CYP3A4 P08684 2/20 0.42
▸ MMP13 P45452 2/20 0.42
▸ MMP2 P08253 1/20 0.42
▸ STAT3 P40763 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41

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
SCHEMBL9587518 0.82 L3MBTL1 (0.53) L3MBTL1CHRM4ALDH1A1HPGDMAPT
SCHEMBL9587380 0.81 L3MBTL1 (0.54) L3MBTL1BAZ2BALDH1A1HPGDMAPT
SCHEMBL9587856 0.80 SMN1; SMN2 (0.52) L3MBTL1CHRM4ALDH1A1HPGDMAPT
SCHEMBL9473989 0.78 SMN1; SMN2 (0.68) L3MBTL1CHRM4HPGDEPHX2NR1H4
SCHEMBL9474213 0.73 CHRM4 (0.53) CHRM4ALDH1A1HPGDMAPTEPHX2
SCHEMBL10274549 0.72 BAZ2B (0.67) L3MBTL1BAZ2BALDH1A1SMN1; SMN2KDM4E
SCHEMBL920312 0.72 HPGD (0.50) L3MBTL1CHRM4ALDH1A1HPGDMAPT
SCHEMBL29064129 0.72 PPARG (0.57) L3MBTL1BAZ2B
SCHEMBL9473560 0.72 MAPT (0.43) L3MBTL1CHRM4ALDH1A1HPGDMAPT
SCHEMBL8358440 0.72 MMP13 (0.66) L3MBTL1CHRM4ALDH1A1HPGDMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5206259-A Insecticides, acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-27 — — US claimed
US-5206259-A Insecticides, acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-27 — — US disclosed
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