SCHEMBL8553915

SCHEMBL8553915

C=CC(C(=O)O)c1ccccc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CA2 P00918 4/20 0.39
CA1 P00915 3/20 0.39
CA12 O43570 3/20 0.39
CA14 Q9ULX7 3/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
TSHR P16473 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
HPGD P15428 3/20 0.38
CA4 P22748 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HMGB1 P09429 1/20 0.38
CA6 P23280 1/20 0.38

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
SCHEMBL6553848 0.86 GABRA1 (0.43) GABRA1GABRB2PTGS1PTGS2CA2
SCHEMBL10689112 0.81 MAPT (0.41) CYP1A2CYP2C19AKT1CYP2D6SRC
SCHEMBL23299858 0.79 ACP3 (0.42) CYP1A2CYP2C19HPGDALDH1A1AKT1
SCHEMBL2802851 0.79 CYP1A2 (0.37) CA2CA1TSHRCYP1A2CYP2C19
SCHEMBL10769825 0.79 CYP1A2 (0.37) PTGS1CA2CA1CA9TSHR
SCHEMBL11875925 0.78 CA12 (0.41) PTGS1PTGS2CA2CA1CA12
SCHEMBL1823386 0.77 KMT2A (0.49) PTGS1PTGS2CA2CA1CA12
SCHEMBL9960147 0.77 ALDH1A1 (0.45) CYP1A2CYP2C19HPGDKDM4EALDH1A1
SCHEMBL21119246 0.75 CYP1A2 (0.57) CYP1A2CYP2C19HPGDKDM4EAKT1
SCHEMBL12833352 0.75 CYP1A2 (0.57) CYP1A2CYP2C19HPGDKDM4EAKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2468708-B1 Catalytic decarboxylative cross-ketonisation of aryl- and alkylcarboxylic acids using iron catalysts COGNIS IP MAN GMBH (DE) 2016-11-09 EP claimed
EP-2468708-A1 Catalytic decarboxylative cross-ketonisation of aryl- and alkylcarboxylic acids using iron catalysts Cognis IP Management GmbH (DE) 2012-06-27 EP claimed
EP-2468708-B1 Catalytic decarboxylative cross-ketonisation of aryl- and alkylcarboxylic acids using iron catalysts COGNIS IP MAN GMBH (DE) 2016-11-09 EP disclosed
EP-0506085-B1 A reversible thermosensitive recording material and a recording medium using the same MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1999-06-02 EP disclosed
US-5543381-A Rewritable recording medium and a method of recording in the same MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1996-08-06 US disclosed
EP-0530699-B1 A rewritable recording medium and a method of recording in the same MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1995-06-14 EP disclosed
US-5364829-A Rewritable recording medium and a method of recording in the same MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1994-11-15 US disclosed
EP-0530699-A1 A rewritable recording medium and a method of recording in the same MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1993-03-10 EP disclosed
EP-0506085-A1 A reversible thermosensitive recording material and a recording medium using the same MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1992-09-30 EP disclosed