SCHEMBL4450879

SCHEMBL4450879

CCCCCCc1cc2c(cc1OCCCC(=O)O)C(=O)CCC2

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 15/20 0.52
LTB4R2 Q9NPC1 13/20 0.52
TSHR P16473 1/20 0.41
CNR2 P34972 3/20 0.41
CNR1 P21554 2/20 0.41
FFAR4 Q5NUL3 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
SCHEMBL13956434 0.93 LTB4R (0.47) LTB4RLTB4R2TSHRCNR2CNR1
SCHEMBL4453277 0.93 LTB4R (0.47) LTB4RLTB4R2TSHRCNR2CNR1
SCHEMBL4450768 0.89 LTB4R (0.49) LTB4RLTB4R2TSHRCNR2CNR1
SCHEMBL13971111 0.89 LTB4R (0.44) LTB4RLTB4R2TSHR
SCHEMBL4448976 0.83 TSHR (0.42) LTB4RLTB4R2TSHRCNR2CNR1
SCHEMBL13956435 0.83 BRD4 (0.43) LTB4RLTB4R2CNR2CNR1
SCHEMBL13956437 0.83 LTB4R (0.41) LTB4RLTB4R2
SCHEMBL13956465 0.82 TSHR (0.56) LTB4RLTB4R2TSHR
SCHEMBL4445408 0.82 TSHR (0.41) LTB4RLTB4R2TSHRCNR2CNR1
SCHEMBL4460421 0.82 BRD4 (0.58) LTB4RLTB4R2CNR2CNR1

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 LTB4R 341/4885LTB4R2 501/4885TSHR 53/4885

“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.