SCHEMBL9065747

SCHEMBL9065747

COC(=O)c1cc(C(C)c2ccccc2)cc(C(C)c2ccccc2)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
LMNA P02545 1/20 0.42
TYR P14679 1/20 0.42
MAPT P10636 3/20 0.40
MITF O75030 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
BRD4 O60885 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CFTR P13569 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX15 P16050 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
PPARA Q07869 1/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA7 P43166 2/20 0.37
CA9 Q16790 2/20 0.37
CA14 Q9ULX7 2/20 0.37

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
SCHEMBL312340 0.85 TYR (0.46) TSHRTYRMAPTKMT2AMEN1
SCHEMBL8571097 0.84 TYR (0.45) TSHRTYRMAPTKMT2AMEN1
SCHEMBL11759869 0.84 TYR (0.45) TSHRTYRMAPTKMT2AMEN1
SCHEMBL11759875 0.84 TYR (0.45) TSHRTYRMAPTKMT2AMEN1
SCHEMBL9771279 0.84 TYR (0.45) TSHRTYRMAPTKMT2AMEN1
SCHEMBL931199 0.84 TYR (0.45) TSHRTYRMAPTKMT2AMEN1
SCHEMBL8425731 0.84 TYR (0.45) TSHRTYRMAPTKMT2AMEN1
SCHEMBL6476058 0.82 TSHR (0.49) TSHRLMNATYRMAPTMITF
SCHEMBL11759865 0.81 TYR (0.43) TSHRLMNATYRKMT2AMEN1
SCHEMBL9771270 0.81 TYR (0.43) TSHRLMNATYRKMT2AMEN1

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-0470516-B1 Process for producing 3,5-di(alpha-methylbenzyl)salicylic acid derivative, and use of polyvalent-metal-modified product thereof as color developer MITSUI TOATSU CHEMICALS (JP) 1996-03-06 EP disclosed
US-5326739-A Process for producing 3,5-di(α-methylbenzyl)salicylic acid derivative, and use of polyvalent-metal-modified product thereof as color developer MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1994-07-05 US disclosed
US-5274150-A Reacting a salicyclic acid ester with an alpha-methyl-benzyl halide using an acid catalyst and hydrolyzing MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-12-28 US disclosed
EP-0470516-A2 Process for producing 3,5-di(alpha-methylbenzyl)salicylic acid derivative, and use of polyvalent-metal-modified product thereof as color developer MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-02-12 EP disclosed