SCHEMBL2989623

SCHEMBL2989623

CCC(C(=O)OO)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
GAA P10253 1/20 0.50
POLB P06746 4/20 0.49
TP53 P04637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
HPGD P15428 1/20 0.49
ALOX12 P18054 1/20 0.49
NFKB1 P19838 1/20 0.49
APEX1 P27695 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
HSD11B1 P28845 1/20 0.47
KMT2A Q03164 1/20 0.46
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 1/20 0.44

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
SCHEMBL9899716 0.88 ALDH1A1 (0.50) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL7502491 0.87 ALDH1A1 (0.50) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL3195963 0.85 ALDH1A1 (0.48) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL29453019 0.85 ALDH1A1 (0.48) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL21635 0.85 ALDH1A1 (0.48) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL9898512 0.84 ALDH1A1 (0.47) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL8856843 0.83 ALDH1A1 (0.46) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL221850 0.83 ALDH1A1 (0.46) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL9899146 0.83 ALDH1A1 (0.46) ALDH1A1GAAPOLBTP53KDM4E
SCHEMBL9898480 0.83 ALDH1A1 (0.46) ALDH1A1GAAPOLBTP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4015606-A1 METHOD OF CLEANING AND MAINTAINING AN AUTOMATIC DISHWASHING MACHINE Henkel AG & Co. KGaA (DE) 2022-06-22 EP disclosed
EP-1692253-B1 BIOCIDIC DETERGENT ECOLAB INC (US) 2013-07-24 EP disclosed
US-20100189675-A1 COSMETIC USE OF AN IMIDOPERCARBOXYLIC ACID DERIVATIVE AS DESQUAMATING AGENT L'OREAL (FR) 2010-07-29 US disclosed
EP-2157964-A1 COSMETIC USE OF AN IMIDOPERCARBOXYLIC ACID DERIVATIVE AS DESQUAMATING AGENT L'Oreal (FR) 2010-03-03 EP disclosed
US-20090275630-A1 COSMETIC COMPOSITION COMPRISING AN IMIDOPERCARBOXYLIC ACID DERIVATIVE AND A N-ACYLATED AMINO ACID ESTER L'OREAL (FR) 2009-11-05 US disclosed
WO-2009001296-A1 COSMETIC USE OF AN IMIDOPERCARBOXYLIC ACID DERIVATIVE AS DESQUAMATING AGENT L'OREAL (FR) 2008-12-31 WO disclosed
EP-1692253-A1 BIOCIDIC DETERGENT Ecolab Inc. (US) 2006-08-23 EP disclosed
US-20060122090-A1 Biocidic detergent ECOLAB INC. (US) 2006-06-08 US disclosed
WO-2006048047-A1 BIOCIDIC DETERGENT ECOLAB INC. (US) 2006-05-11 WO disclosed
WO-2004106480-A1 BIOCIDIC DETERGENT ECOLAB INC. (US) 2004-12-09 WO disclosed
EP-1482026-A1 Biocidic detergent ECOLAB INC. (US) 2004-12-01 EP disclosed
EP-0473637-B1 PEROXYACID MANUFACTURE SOLVAY INTEROX LTD (GB) 1995-03-22 EP disclosed
US-5326904-A For low temperature detergents SOLVAY INTEROX LIMITED (GB) 1994-07-05 US disclosed
US-5220052-A Controlling the rate of addition of a solution of carboxylic acid in concentrated sulfuric acid to Caro's solution having a particular range of components, i.e. hydrogen peroxide, water and sulfuric acid INTEROX CHEMICALS LIMITED (GB) 1993-06-15 US disclosed
EP-0473637-A1 PEROXYACID MANUFACTURE. INTEROX CHEMICALS LTD (GB) 1992-03-11 EP disclosed
WO-1990014336-A1 PEROXYACID MANUFACTURE INTEROX CHEMICALS LIMITED (GB) 1990-11-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100189675-A1 COSMETIC USE OF AN IMIDOPERCARBOXYLIC ACID DERIVATIVE AS DESQUAMATING AGENT NISCH, CUTA, DDC ALDH1A1 1251/4885GAA 2026/4885POLB 2002/4885
US-20090275630-A1 COSMETIC COMPOSITION COMPRISING AN IMIDOPERCARBOXYLIC ACID DERIVATIVE AND A N-ACYLATED AMINO ACID ESTER DDC, ALAD, AADAC ALDH1A1 407/4885GAA 2961/4885POLB 3271/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.