SCHEMBL9848848

SCHEMBL9848848

O=C(CF)Nc1ccccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.57
GAA P10253 6/20 0.53
NPC1 O15118 4/20 0.53
LMNA P02545 2/20 0.53
HTT P42858 2/20 0.53
TP53 P04637 2/20 0.53
MAPT P10636 4/20 0.51
KMT2A Q03164 6/20 0.51
RAB9A P51151 5/20 0.51
MEN1 O00255 5/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PKM P14618 1/20 0.51
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL13416408 0.85 KDM1A (0.68) KDM1AGAANPC1LMNAHTT
SCHEMBL10955276 0.82 KDM1A (0.59) KDM1AGAANPC1LMNAHTT
SCHEMBL4604147 0.80 ALDH1A1 (0.57) KDM1AGAANPC1LMNAHTT
SCHEMBL860003 0.80 KDM1A (0.57) KDM1AGAANPC1LMNAHTT
SCHEMBL17550098 0.80 KDM1A (0.62) KDM1AGAANPC1LMNAHTT
SCHEMBL763528 0.80 KDM1A (0.57) KDM1AGAANPC1LMNAHTT
SCHEMBL968912 0.80 CA1 (0.64) KDM1AGAANPC1LMNAHTT
SCHEMBL7982548 0.80 SMN1; SMN2 (0.64) GAANPC1HTTMAPTKMT2A
SCHEMBL4361189 0.80 KDM1A (0.62) KDM1AGAANPC1LMNAHTT
SCHEMBL15338073 0.78 L3MBTL1 (0.57) NPC1LMNAHTTMAPTKMT2A

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
EP-0410471-A2 2-alkyl-4-methoxy-5-aminophenol or salt thereof, or 2-alkyl-4-methoxy-5-substituted aminophenol or salt thereof, and dyeing composition for keratin fibers comprising the same Kao Corporation (JP) 1991-01-30 EP disclosed