SCHEMBL872529

SCHEMBL872529

CCN(CC)c1cccc(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
CYP3A4 P08684 1/20 0.56
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
L3MBTL1 Q9Y468 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 3/20 0.48
PKM P14618 3/20 0.48
MAPK1 P28482 3/20 0.48
USP2 O75604 1/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
MCL1 Q07820 1/20 0.48
NOX1 Q9Y5S8 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA6 P23280 1/20 0.47
CA9 Q16790 1/20 0.47
HCAR3 P49019 1/20 0.46

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
SCHEMBL10687016 0.87 TSHR (0.62) ALDH1A1KMT2AMEN1L3MBTL1TSHR
SCHEMBL10689801 0.87 ALDH1A1 (0.47) ALDH1A1CYP3A4KMT2AHCAR3POLB
SCHEMBL2742811 0.87 ALDH1A1 (0.58) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1
SCHEMBL610585 0.86 L3MBTL1 (0.57) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1
SCHEMBL872723 0.86 HCAR3 (0.49) ALDH1A1KMT2ACA12CA1CA2
SCHEMBL11739758 0.85 MAPT (0.63) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1
SCHEMBL11809714 0.85 ALDH1A1 (0.56) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1
Benzoic Acid SCHEMBL28813195 0.85 ALDH1A1 (0.72) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1
SCHEMBL11581341 0.84 ALDH1A1 (0.55) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1
SCHEMBL3107249 0.84 ALDH1A1 (0.55) ALDH1A1CYP3A4KMT2AMEN1L3MBTL1

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110678450-B Isoxazole derivatives as nuclear receptor agonists and uses thereof 日东制药株式会社 2023-06-20 CN claimed
EP-1167540-B1 Dye couple for spectrophotometric determination of analytes LIFESCAN INC (US) 2007-06-20 EP claimed
CN-110678450-B Isoxazole derivatives as nuclear receptor agonists and uses thereof 日东制药株式会社 2023-06-20 CN disclosed
CN-103703114-B There is the lubricating composition improving tbn retention THE LUBRIZOL CORP. (US) 2016-02-10 CN disclosed
US-9222051-B2 Lubricating composition with improved TBN retention THE LUBRIZOL CORPORATION (US) 2015-12-29 US disclosed
CN-103210069-B Aminobenzoic acid derivatives THE LUBRIZOL CORP. (US) 2015-11-25 CN disclosed
US-20140187458-A1 Lubricating Composition With Improved TBN Retention THE LUBRIZOL CORPORATION (US) 2014-07-03 US disclosed
CN-103703114-A Lubricating composition with improved tbn retention LUBRIZOL CORP 2014-04-02 CN disclosed
US-20130281336-A1 Aminobenzoic Acid Derivatives THE LUBRIZOL CORPORATION (US) 2013-10-24 US disclosed
EP-2619293-A1 AMINOBENZOIC ACID DERIVATIVES The Lubrizol Corporation (US) 2013-07-31 EP disclosed
CN-103210069-A Aminobenzoic acid derivatives LUBRIZOL CORP 2013-07-17 CN disclosed
EP-0127203-B1 NEW PHTHALIDE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND RECORDING SYSTEM UTILIZING THE SAME AS COLOURLESS CHROMOGENIC MATERIAL KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1989-06-28 EP disclosed
EP-0305093-A1 Imidazo(1,2-b)pyridazine derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1989-03-01 EP disclosed
US-4732991-A Substituted phthalides HILTON DAVIS CHEMICAL CO. (US) 1988-03-22 US disclosed
US-4595768-A 3-(substituted phenyl)phthalides THE HILTON-DAVIS CHEMICAL CO. (US) 1986-06-17 US disclosed
US-4528136-A Process for preparing 2-[bis(aryl)methyl]benzoic acids THE HILTON-DAVIS CHEMICAL CO. (US) 1985-07-09 US disclosed
US-4399291-A CONDENSATION OF A BENZALDEHYDE, AN ANILINE, AN AMINOBENZOIC ACID; OXIDATION STERLING DRUG INC. (US) 1983-08-16 US disclosed
EP-0082394-A2 A process for the production of aminophthalides and amino benzoic acids STERLING DRUG INC. (US) 1983-06-29 EP disclosed
EP-0014031-A1 Water-soluble monoazo dyes of the azobenzene series, their preparation and process for the colouration of polyamide textile materials IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-08-06 EP disclosed
US-3936462-A CNS DEPRESSANT, ANALGESIC STERLING DRUG INC. (US) 1976-02-03 US disclosed