SCHEMBL10429975

SCHEMBL10429975

O=C(OCc1ccccc1)C(O)CNc1ccccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
LMNA P02545 2/20 0.45
KMT2A Q03164 3/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
THRB P10828 1/20 0.43
ALOX12 P18054 1/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
MCL1 Q07820 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 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
SCHEMBL9526385 0.84 LMNA (0.40) TDP1LMNAKMT2ASLC6A2SLC6A3
SCHEMBL27803980 0.82 KMT2A (0.50) TDP1LMNAKMT2ASLC6A2SLC6A3
SCHEMBL9527633 0.81 RAB9A (0.50) LMNAKMT2ARAB9AALDH1A1KDM4E
SCHEMBL9525716 0.81 ITGA4 (0.54) TDP1LMNAKMT2ANPC1RAB9A
SCHEMBL28598894 0.78 ALDH1A1 (0.53) TDP1LMNAKMT2ASLC6A2SLC6A3
SCHEMBL23994825 0.75 TDP1 (0.55) TDP1LMNAKMT2ASLC6A2SLC6A3
SCHEMBL3667152 0.75 SLC6A2 (0.49) TDP1LMNAKMT2ASLC6A2SLC6A3
SCHEMBL10429974 0.74 TDP1 (0.48) TDP1LMNAKMT2ASLC6A2SLC6A3
SCHEMBL30522295 0.74 NPC1 (0.69) TDP1LMNANPC1RAB9AMAPT
SCHEMBL16193532 0.74 NPC1 (0.69) TDP1LMNANPC1RAB9AMAPT

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-0366542-A1 5-Substituted ortho-aminophenols, process for their preparation and their use in the oxidation dyeing of keratinic fibres L'OREAL (FR) 1990-05-02 EP disclosed