SCHEMBL51572

SCHEMBL51572

CC(c1ccc(Cl)cc1O)c1ccc(Cl)cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
CYP3A4 P08684 3/20 0.50
TSHR P16473 2/20 0.50
LMNA P02545 5/20 0.47
HTT P42858 4/20 0.47
TP53 P04637 1/20 0.47
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
MAPT P10636 3/20 0.46
MAPK1 P28482 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TYR P14679 1/20 0.46
SLC6A2 P23975 2/20 0.43
TRPA1 O75762 1/20 0.43
CHRM1 P11229 1/20 0.43
ADRA1A P35348 1/20 0.43
HTR2B P41595 1/20 0.43
HPGD P15428 6/20 0.42

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
SCHEMBL10053115 0.86 LMNA (0.59) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL51491 0.82 MEN1 (0.59) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL28490762 0.79 LMNA (0.50) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL27697380 0.78 PTGS2 (0.45) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL51618 0.76 TYR (0.70) LMNATYRSLC6A2TRPA1CHRM1
SCHEMBL18097894 0.76 TP53 (0.68) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL1758126 0.76 HSD17B10 (0.48) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL15459927 0.75 GABRA1 (0.55) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL15459931 0.75 GABRA1 (0.55) ALDH1A1HSD17B10TDP1CYP3A4TSHR
SCHEMBL51957 0.74 LMNA (0.75) ALDH1A1HSD17B10TDP1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181853-B1 Thermosensitive recording medium JUJO PAPER CO LTD (JP) 2015-09-23 EP disclosed
US-8129307-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2012-03-06 US disclosed
EP-2112001-B1 THERMOSENSITIVE RECORDING MEDIUM JUJO PAPER CO LTD (JP) 2011-05-11 EP disclosed
US-20100099557-A1 Thermosensitive Recording Medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2010-04-22 US disclosed