SCHEMBL9826705

SCHEMBL9826705

COc1ccc(CCc2ccc(NC(=O)c3ccccc3O)cc2)cc1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 6/20 0.69
▸ KMT2A Q03164 8/20 0.58
▸ MEN1 O00255 7/20 0.58
▸ PNLIP P16233 1/20 0.56
▸ SMN1; SMN2 Q16637 5/20 0.56
▸ HTT P42858 4/20 0.56
▸ MAPT P10636 4/20 0.56
▸ KDM4E B2RXH2 3/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ KLKB1 P03952 1/20 0.54
▸ LMNA P02545 4/20 0.53
▸ TP53 P04637 3/20 0.53
▸ NPC1 O15118 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ GAA P10253 1/20 0.52
▸ HPGD P15428 1/20 0.51

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
SCHEMBL9826567 0.88 THRB (0.54) ALOX15KMT2AMEN1SMN1; SMN2HTT
SCHEMBL9827104 0.86 ALOX15 (0.72) ALOX15KMT2AMEN1HTTMAPT
SCHEMBL10386151 0.85 ALOX15 (0.71) ALOX15KMT2AMEN1PNLIPHTT
SCHEMBL9826900 0.82 ALOX15 (1.00) ALOX15KMT2AMEN1SMN1; SMN2HTT
SCHEMBL7168892 0.80 CYP3A4 (0.55) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL7168899 0.79 ABCB1 (0.59) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL29828287 0.78 KMT2A (0.61) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL10829624 0.78 KMT2A (0.61) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL19248291 0.77 KMT2A (0.73) ALOX15KMT2AMEN1PNLIPSMN1; SMN2
SCHEMBL19077954 0.77 ALOX15 (0.67) ALOX15KMT2AMEN1PNLIPSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0221346-B1 (N-SUBSTITUTED-2-HYDROXY) BENZAMIDES AND N-SUBSTITUTED-2-HYDROXY-ALPHA-OXO-BENZENEACETAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF HAVING ACTIVITY AS MODULATORS OF THE ARACHIDONIC ACID CASCADE WARNER-LAMBERT COMPANY (US) 1991-01-30 — — EP disclosed
US-4939133-A N-substituted-2-hydroxy-α-oxo-benzeneacetamides and pharmaceutical compositions having activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1990-07-03 — — US disclosed
EP-0221346-A1 (N-substituted-2-hydroxy) benzamides and N-substituted-2-hydroxy-alpha-oxo-benzeneacetamides and pharmaceutical compositions thereof having activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1987-05-13 — — EP disclosed
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