SCHEMBL8767646

SCHEMBL8767646

Cc1ccccc1Cc1cc(O)ccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
ALDH1A1 P00352 4/20 0.44
TSHR P16473 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
HMGB1 P09429 1/20 0.44
CXCL12 P48061 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
EGFR P00533 1/20 0.44
LCK P06239 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PTPN1 P18031 3/20 0.43
PTPN2 P17706 2/20 0.43

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
SCHEMBL29389870 0.85 ALDH1A1 (0.59) ALDH1A1TSHRCA12CA1CA2
SCHEMBL310681 0.83 PTPN1 (0.58) ALDH1A1TSHRCA12CA1CA2
SCHEMBL28205348 0.83 TSHR (0.61) HTTALDH1A1TSHRCA1CA2
SCHEMBL8890939 0.83 HTT (0.46) HTTALDH1A1TSHRHMGB1CXCL12
SCHEMBL4351346 0.81 TP53 (0.50) HTTALDH1A1TSHRCA12CA1
SCHEMBL10607918 0.81 TSHR (0.48) HTTTSHRCA1CA2CA9
SCHEMBL1490091 0.79 EGFR (0.48) HTTALDH1A1TSHRCA12CA1
SCHEMBL10599031 0.79 PTPN1 (0.49) ALDH1A1TSHRCA12CA1CA2
SCHEMBL6698417 0.78 LDHA (0.47) TSHRPTPN1PTPN2PTPN6
SCHEMBL7759834 0.78 KEAP1 (0.48) HTTALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585127-B1 Thermal Recording sheet JUJO PAPER CO LTD (JP) 1997-12-29 EP disclosed
EP-0570186-B1 Thermal recording sheet JUJO PAPER CO LTD (JP) 1997-08-13 EP disclosed
US-5405821-A Containing a 4-hydroxyphenylarylsulfone color developer NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1995-04-11 US disclosed
EP-0570186-A1 Thermal recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1993-11-18 EP disclosed
US-4727162-A COLOR FORMERS FOR HEAT OR PRESSURE RECORDING MATERIAL SHIN NISSO KAKO CO., LTD. (JP) 1988-02-23 US disclosed
US-4695640-A COLOR FORMER FOR RECORDING MATERIALS SHIN NISSO KAKO CO., LTD. (JP) 1987-09-22 US disclosed