SCHEMBL4452252

SCHEMBL4452252

CCCCCCc1cc2c(cc1O)C(=O)CCC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
TYR P14679 2/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX5 P09917 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
PRKCI P41743 1/20 0.42
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GPR84 Q9NQS5 7/20 0.38
HSD17B1 P14061 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NOD2 Q9HC29 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
SCHEMBL2305004 0.92 TYR (0.46) MEN1KMT2AMAPTHTTTYR
SCHEMBL4450227 0.81 HSD17B1 (0.50) ALOX5TSHRMAPK1GPR84HSD17B1
SCHEMBL4450879 0.79 LTB4R (0.52) TSHR
SCHEMBL2286696 0.74 MAOA (0.50) MAOAMAOBPRKCIHSD17B1
SCHEMBL2301656 0.74 HSD17B1 (0.37) MEN1KMT2AMAPTHTTTYR
SCHEMBL10523260 0.74 MAOA (0.48) MAOAMAOB
SCHEMBL2302044 0.74 MAPT (0.43) MEN1KMT2AMAPTHTTTYR
SCHEMBL11810833 0.73 MEN1 (0.52) MEN1KMT2AMAOAMAOBPRKCI
SCHEMBL423181 0.73 MAOA (0.60) MEN1KMT2AMAPTMAOAMAOB
SCHEMBL8942889 0.73 ALOX5 (0.68) MEN1KMT2AMAPTHTTTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583738-B1 INDENONCARBOXYLIC ACIDS DERIVATIVES AND THEIR USE FOR THE TREATMENT OF AND PREVENTING DIABETES AND DYSLIPIDAEMIA MERCK PATENT GMBH (DE) 2017-05-10 EP disclosed
US-7482484-B2 Carboxylic acids and derivatives for the treatment of and preventing diabetes and dyslipidaemia MERCK PATENT GMBH (DE) 2009-01-27 US disclosed
US-20060111445-A1 Novel carboxylic acids and derivatives for the treatment of and preventing diabetes and dyslipidaemia MERCK PATENT GMBH (DE) 2006-05-25 US disclosed
EP-1583738-A1 INDENONCARBOXYLIC ACIDS DERIVATIVES AND THEIR USE FOR THE TREATMENT OF AND PREVENTING DIABETES AND DYSLIPIDAEMIA MERCK PATENT GmbH (DE) 2005-10-12 EP disclosed
WO-2004063148-A1 INDENONCARBOXYLIC ACIDS DERIVATIVES AND THEIR USE FOR THE TREATMENT OF AND PREVENTING DIABETES AND DYSLIPIDAEMIA MERCK PATENT GMBH (DE) 2004-07-29 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 (1 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-20060111445-A1 Novel carboxylic acids and derivatives for the treatment of and preventing diabetes and dyslipidaemia NR1H3, LDLR, NR1H2 MEN1 3761/4885KMT2A 1915/4885MAPT 4833/4885

“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.