SCHEMBL13464473

SCHEMBL13464473

COc1ccc(C(=O)NC2(C(=O)O)CCC(C)(C)CC2)cc1OCCc1cc(OC(F)(F)F)ccc1F

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 5/20 0.66
▸ FFAR4 Q5NUL3 2/20 0.42
▸ SCD O00767 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ GRM7 Q14831 3/20 0.39
▸ ABL1 P00519 2/20 0.38
▸ F10 P00742 4/20 0.37
▸ PPARD Q03181 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ FFAR1 O14842 1/20 0.36

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
SCHEMBL1811240 0.91 LPAR1 (0.64) LPAR1FFAR4SCDPDE4DGRM7
SCHEMBL1811246 0.91 LPAR1 (0.64) LPAR1FFAR4SCDPDE4DGRM7
SCHEMBL1811242 0.91 LPAR1 (0.64) LPAR1FFAR4SCDPDE4DGRM7
SCHEMBL1560966 0.88 LPAR1 (0.61) LPAR1FFAR4SCDPDE4DGRM7
SCHEMBL13464534 0.88 LPAR1 (0.85) LPAR1F10
SCHEMBL1811932 0.80 LPAR1 (0.84) LPAR1PDE4DF10
SCHEMBL1810284 0.80 LPAR1 (1.00) LPAR1F10
SCHEMBL1812645 0.80 LPAR1 (0.84) LPAR1PDE4DF10
SCHEMBL1811345 0.80 LPAR1 (0.51) LPAR1FFAR4ABL1
SCHEMBL1811347 0.80 LPAR1 (0.51) LPAR1FFAR4ABL1

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-20120264790-A1 ACYLAMINO-SUBSTITUTED CYCLIC CARBOXYLIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2012-10-18 — — 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-20120264790-A1 ACYLAMINO-SUBSTITUTED CYCLIC CARBOXYLIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS LPAR2, LIPG, EDF1 LPAR1 4/4885FFAR4 108/4885SCD 1567/4885

“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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