SCHEMBL6629484

SCHEMBL6629484

Oc1c[c]c2cccc(O)c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.37
HPGD P15428 3/20 0.37
ALOX15 P16050 3/20 0.37
RECQL P46063 3/20 0.37
TDP1 Q9NUW8 3/20 0.37
MAPT P10636 2/20 0.37
CYP1A2 P05177 1/20 0.37
APP P05067 1/20 0.37
THRB P10828 1/20 0.37
TSHR P16473 1/20 0.37
CASP1 P29466 1/20 0.37
SNCA P37840 1/20 0.37
ESR1 P03372 3/20 0.36
ESR2 Q92731 3/20 0.36
HSD17B1 P14061 2/20 0.36
HSD17B2 P37059 2/20 0.36
PLAU P00749 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
ALDH1A1 P00352 4/20 0.33
CA2 P00918 3/20 0.33

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
SCHEMBL4600220 0.71 ALDH1A1 (0.44) HSD17B10HPGDTDP1MAPTCYP1A2
SCHEMBL3952850 0.70 CYP1A2 (0.44) HSD17B10HPGDTDP1MAPTCYP1A2
SCHEMBL386939 0.70 HSD17B10 (0.44) HSD17B10HPGDALOX15RECQLTDP1
SCHEMBL5032964 0.69 MCL1 (0.38) HSD17B10ALOX15TDP1CYP1A2TSHR
SCHEMBL6633728 0.68 ESR1 (0.32) HSD17B10ALOX15MAPTTSHRESR1
SCHEMBL6633925 0.67 ALDH1A1 (0.39) HSD17B10HPGDALOX15RECQLTDP1
SCHEMBL7193577 0.65 CYP1A2 (0.50) HSD17B10HPGDALOX15RECQLTDP1
SCHEMBL6630598 0.65 PTPN22 (0.41) HSD17B10HPGDALOX15RECQLTDP1
SCHEMBL734138 0.64 NQO2 (0.54) HSD17B10HPGDALOX15RECQLTDP1
SCHEMBL31037127 0.64 NQO2 (0.54) HSD17B10HPGDALOX15RECQLTDP1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1276035-C Water-color ink MITSUI CHEMICALS INC (JP) 2006-09-20 CN disclosed
CN-1558934-A Water-color ink 三井化学株式会社 2004-12-29 CN disclosed
US-20040231558-A1 Has a clear hue, high light fastness and high moisture resistance MITSUI CHEMICALS, INC. (JP) 2004-11-25 US disclosed
EP-1441013-A1 WATERCOLOR INK Mitsui Chemicals, Inc. (JP) 2004-07-28 EP disclosed
US-6528655-B1 Hydroxyphenyl diamido derivatives PHARMACOR, INC. (CA) 2003-03-04 US disclosed