SCHEMBL13464509

SCHEMBL13464509

COc1ncc(C(=O)NC2(C(=O)O)CCC(C)(C)CC2)cc1OCCc1cccc(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 6/20 0.65
▸ GPR132 Q9UNW8 2/20 0.40
▸ F10 P00742 2/20 0.39
▸ CTSA P10619 2/20 0.39
▸ SCD O00767 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ HIF1A Q16665 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL1811011 0.92 LPAR1 (0.77) LPAR1GPR132F10SCDMAOB
SCHEMBL13464586 0.91 LPAR1 (0.52) LPAR1GPR132HDAC1
SCHEMBL1810960 0.90 LPAR1 (0.63) LPAR1GPR132F10SCDMAOB
SCHEMBL1810958 0.90 LPAR1 (0.63) LPAR1GPR132F10SCDMAOB
SCHEMBL1810959 0.90 LPAR1 (0.63) LPAR1GPR132F10SCDMAOB
SCHEMBL1810270 0.89 LPAR1 (0.62) LPAR1GPR132F10SCDMAOB
SCHEMBL1810275 0.89 LPAR1 (0.62) LPAR1GPR132F10SCDMAOB
SCHEMBL1810272 0.89 LPAR1 (0.62) LPAR1GPR132F10SCDMAOB
SCHEMBL13464536 0.88 LPAR1 (0.61) LPAR1GPR132F10SCDMAOB
SCHEMBL13464505 0.84 LPAR1 (0.75) LPAR1GPR132F10SCDHDAC1

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 4/4885GPR132 518/4885F10 112/4885

“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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