SCHEMBL12646513

SCHEMBL12646513

CC(=O)c1ccccc1-c1ccc(CCC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 15/20 0.62
▸ KEAP1 Q14145 1/20 0.55
▸ FFAR4 Q5NUL3 10/20 0.52
▸ PTGER1 P34995 1/20 0.51
▸ PTGER4 P35408 1/20 0.51
▸ PTGER3 P43115 1/20 0.51
▸ PTGER2 P43116 1/20 0.51
▸ LTB4R2 Q9NPC1 1/20 0.49
▸ PPARD Q03181 1/20 0.49
▸ PPARA Q07869 1/20 0.49

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
SCHEMBL12646449 0.84 SLC6A3 (0.46) FFAR1FFAR4LTB4R2
SCHEMBL12646566 0.83 FFAR1 (0.81) FFAR1KEAP1FFAR4PTGER1PTGER4
SCHEMBL1510067 0.81 FFAR1 (0.66) FFAR1KEAP1FFAR4PTGER1PTGER4
SCHEMBL1515723 0.79 BCAT2 (0.59) LTB4R2
SCHEMBL12646564 0.79 FFAR1 (0.67) FFAR1KEAP1FFAR4PTGER1PTGER4
SCHEMBL294730 0.79 BCAT2 (0.63) —
SCHEMBL31125227 0.79 BCAT2 (0.63) —
SCHEMBL10449002 0.79 BRS3 (0.46) LTB4R2
SCHEMBL14132409 0.79 LTB4R2 (0.49) LTB4R2
SCHEMBL27431910 0.79 LTB4R2 (0.49) LTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES SYDDANSK UNIVERSITET 2011-06-23 — — US 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-20110152315-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISEASES GPR119, INSR, GPR65 FFAR1 6/4885KEAP1 1257/4885FFAR4 12/4885

“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.

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