SCHEMBL2938159

SCHEMBL2938159

N#CC(=O)Cc1ccccc1-c1c(N)cccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
HPGD P15428 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
PABPC1 P11940 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
BLM P54132 2/20 0.39
POLB P06746 1/20 0.39
CSNK1A1 P48729 1/20 0.39
CSNK1D P48730 1/20 0.39
MCL1 Q07820 1/20 0.39
PLEC Q15149 1/20 0.39
CSNK1G1 Q9HCP0 1/20 0.39
AKR1B1 P15121 1/20 0.37
PTPRC P08575 1/20 0.35
ADORA2A P29274 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ALOX15 P16050 3/20 0.34
TSHR P16473 2/20 0.34

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
SCHEMBL2941057 0.81 HPGD (0.40) MEN1KMT2AHPGDTDP1PABPC1
SCHEMBL2940033 0.76 TSHR (0.33) MEN1KMT2AHPGDTDP1PABPC1
SCHEMBL2939528 0.76 DPP4 (0.46) MEN1KMT2AHPGDTDP1PABPC1
SCHEMBL2941542 0.74 CNR2 (0.36) ALDH1A1
SCHEMBL2938263 0.71 ALOX15 (0.54) MEN1KMT2AHPGDTDP1PABPC1
SCHEMBL2938819 0.71 ALOX15 (0.54) MEN1KMT2AHPGDTDP1PABPC1
SCHEMBL30136525 0.71 ALOX15 (0.54) MEN1KMT2AHPGDTDP1PABPC1
Hydrochloric Acid SCHEMBL2936725 0.69 ALOX15 (0.52) MEN1KMT2AHPGDTDP1PABPC1
SCHEMBL30434982 0.69 ALOX15 (0.52) MEN1KMT2AHPGDTDP1PABPC1
SCHEMBL2931225 0.66 ALOX15 (0.46) MEN1KMT2AHPGDTDP1PABPC1

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-1494995-B1 3-AMINOPHENOL DERIVATIVES SUBSTITUTED IN THE 2-POSITION, AND DYES CONTAINING THESE COMPOUNDS PROCTER & GAMBLE (US) 2010-09-22 EP claimed