SCHEMBL9587518

SCHEMBL9587518

CSc1ccc(Oc2ccc(CNC(=O)c3cc(C)nn3C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ CHRM4 P08173 2/20 0.47
▸ MAPT P10636 2/20 0.45
▸ PHGDH O43175 1/20 0.45
▸ MLLT3 P42568 1/20 0.45
▸ MLLT1 Q03111 1/20 0.45
▸ PPARG P37231 1/20 0.45
▸ PPARD Q03181 1/20 0.45
▸ PPARA Q07869 1/20 0.45
▸ KLKB1 P03952 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ EPHX2 P34913 1/20 0.44
▸ NR1H4 Q96RI1 1/20 0.44
▸ TP53 P04637 2/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ MAPK14 Q16539 2/20 0.43
▸ MMP2 P08253 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ STAT3 P40763 1/20 0.42

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
SCHEMBL9587376 0.82 L3MBTL1 (0.53) L3MBTL1CHRM4MAPTMLLT3MLLT1
SCHEMBL9587530 0.81 L3MBTL1 (0.54) L3MBTL1MAPTPHGDHPPARGPPARD
SCHEMBL9587856 0.80 SMN1; SMN2 (0.52) L3MBTL1CHRM4MAPTMLLT3MLLT1
SCHEMBL9198501 0.80 L3MBTL1 (0.58) L3MBTL1MAPTPHGDHPPARGPPARD
SCHEMBL9195354 0.80 L3MBTL1 (0.64) L3MBTL1MAPTPHGDHPPARGPPARD
SCHEMBL9473989 0.78 SMN1; SMN2 (0.68) L3MBTL1CHRM4MLLT3MLLT1HPGD
SCHEMBL920312 0.74 HPGD (0.50) L3MBTL1CHRM4MAPTALDH1A1HPGD
SCHEMBL21580166 0.74 L3MBTL1 (0.51) L3MBTL1MAPTPHGDHKLKB1ALDH1A1
SCHEMBL9474213 0.73 CHRM4 (0.53) CHRM4MAPTMLLT3MLLT1ALDH1A1
SCHEMBL12501227 0.72 L3MBTL1 (0.48) L3MBTL1ALDH1A1HPGDCYP3A4SMN1; SMN2

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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