SCHEMBL13276430

SCHEMBL13276430

CC[C@H]1CC[C@](NC(=O)c2cc(F)c(OC)c(OCCc3cccc(CCO)c3)c2)(C(=O)O)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 6/20 0.51
▸ F10 P00742 4/20 0.38
▸ GPR132 Q9UNW8 2/20 0.38
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL6845254 1.00 LPAR1 (0.51) LPAR1F10GPR132CYP4F2CYP4A11
SCHEMBL13276433 1.00 LPAR1 (0.51) LPAR1F10GPR132CYP4F2CYP4A11
SCHEMBL12095349 0.92 LPAR1 (0.58) LPAR1F10GPR132CYP4F2CYP4A11
SCHEMBL12095350 0.92 LPAR1 (0.58) LPAR1F10GPR132CYP4F2CYP4A11
SCHEMBL12095348 0.92 LPAR1 (0.58) LPAR1F10GPR132CYP4F2CYP4A11
SCHEMBL1809808 0.89 LPAR1 (0.61) LPAR1GPR132L3MBTL1
SCHEMBL1812191 0.87 LPAR1 (0.66) LPAR1F10GPR132PDE4D
SCHEMBL1812195 0.87 LPAR1 (0.66) LPAR1F10GPR132PDE4D
SCHEMBL1812192 0.87 LPAR1 (0.66) LPAR1F10GPR132PDE4D
SCHEMBL1809796 0.86 LPAR1 (0.51) LPAR1F10GPR132CYP4F2CYP4A11

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 4/4885F10 112/4885GPR132 518/4885

“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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