SCHEMBL9702060

SCHEMBL9702060

Oc1ccc(NCc2ccc3cc(O)ccc3c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.58
GAA P10253 6/20 0.58
MEN1 O00255 5/20 0.58
BLM P54132 5/20 0.58
KMT2A Q03164 5/20 0.58
ALDH1A1 P00352 4/20 0.58
L3MBTL1 Q9Y468 4/20 0.58
THRB P10828 3/20 0.58
POLB P06746 3/20 0.58
HPGD P15428 2/20 0.58
ALOX15 P16050 2/20 0.58
MAPK1 P28482 2/20 0.58
CASP1 P29466 2/20 0.58
HSD17B10 Q99714 2/20 0.58
KDM4E B2RXH2 2/20 0.58
AGER Q15109 1/20 0.58
HSP90AA1 P07900 1/20 0.58
HSP90AB1 P08238 1/20 0.58
PLEC Q15149 1/20 0.58
APAF1 O14727 1/20 0.58

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
SCHEMBL9702743 0.89 INSR (0.67) MAPTGAAMEN1BLMKMT2A
SCHEMBL9702101 0.84 MAPT (0.57) MAPTGAAMEN1BLMKMT2A
SCHEMBL6795311 0.82 MAPT (0.80) MAPTGAAMEN1BLMKMT2A
SCHEMBL10055010 0.82 MAPT (0.80) MAPTGAAMEN1BLMKMT2A
SCHEMBL11511077 0.79 HIF1A (0.67) MAPTGAAMEN1BLMKMT2A
SCHEMBL13219246 0.77 CYP1A2 (0.45) ALOX15MAPK1HSD17B10PKMTDP1
SCHEMBL4670284 0.77 ALOX5 (0.46) MAPTALOX15HSD17B10KDM4ETDP1
SCHEMBL22773430 0.76 MAPT (0.71) MAPTGAAMEN1BLMKMT2A
SCHEMBL10184604 0.76 MEN1 (0.60) MAPTGAAMEN1BLMKMT2A
Bromide SCHEMBL27590510 0.76 ALOX5 (0.45) MAPTALOX15HSD17B10KDM4ETDP1

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
EP-0221677-B1 P-AMINOPHENOLS, DERIVATIVES THEREOF AND USE FOR MANUFACTURE OF A MEDICAMENT E.R. Squibb & Sons, Inc. (US) 1992-09-09 EP disclosed
EP-0221677-A2 p-Aminophenols, derivatives thereof and use for manufacture of a medicament E.R. Squibb & Sons, Inc. (US) 1987-05-13 EP disclosed