SCHEMBL7758673

SCHEMBL7758673

CC(CO)Cc1ccccc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.49
ALDH1A1 P00352 2/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
MAPT P10636 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
ELANE P08246 1/20 0.42
TRPA1 O75762 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CLCN2 P51788 1/20 0.41
HIF1A Q16665 2/20 0.41
CYP2C9 P11712 1/20 0.41
HTT P42858 2/20 0.41
TP53 P04637 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.40

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
SCHEMBL9724906 0.86 FOLH1 (0.49) FOLH1ALDH1A1ALOX15TSHRMAPT
SCHEMBL9724910 0.86 FOLH1 (0.49) FOLH1ALDH1A1ALOX15TSHRMAPT
SCHEMBL15543860 0.84 FOLH1 (0.48) FOLH1ALDH1A1ALOX15TSHRMAPT
SCHEMBL21829032 0.84 FOLH1 (0.48) FOLH1ALDH1A1ALOX15TSHR
SCHEMBL5819855 0.84 FOLH1 (0.48) FOLH1ALDH1A1ALOX15TSHRMAPT
SCHEMBL3281697 0.84 FOLH1 (0.50) FOLH1ALDH1A1ALOX15TSHRMAPT
SCHEMBL157592 0.83 FOLH1 (0.53) FOLH1ALDH1A1ALOX15TSHRMAPT
SCHEMBL2578003 0.83 FOLH1 (0.50) FOLH1ALDH1A1ALOX15TSHRMAPT
SCHEMBL29644540 0.83 FOLH1 (0.50) FOLH1ALDH1A1ALOX15TSHRMAPT
Phthalic Acid SCHEMBL29613048 0.83 ALDH1A1 (0.61) ALDH1A1ALOX15MAPTHDAC8TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0778157-B1 A thermal recording medium JUJO PAPER CO LTD (JP) 2001-04-04 EP disclosed
US-5811368-A BASIC LEUCO DYE, PHENOLIC COLOR DEVELOPER; IMPROVED STABILITY TO PLASTICIZERS NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-09-22 US disclosed
EP-0778157-A2 A thermal recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1997-06-11 EP disclosed