SCHEMBL12585296

SCHEMBL12585296

C[C@H](NC(=O)c1cc(Cl)cn1Cc1ccc(Cl)cc1)c1ccc(C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 9/20 0.56
PTGER4 P35408 11/20 0.56
PTGDR Q13258 6/20 0.54
PTGER2 P43116 1/20 0.53

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
SCHEMBL12585324 0.91 PHGDH (0.54) PHGDHPTGER4PTGDRPTGER2
SCHEMBL13619519 0.89 PTGER4 (0.48) PHGDHPTGER4PTGDRPTGER2
SCHEMBL12585740 0.89 PTGER4 (0.56) PHGDHPTGER4PTGDRPTGER2
SCHEMBL10085618 0.84 PTGER4 (0.58) PHGDHPTGER4PTGDRPTGER2
SCHEMBL12948788 0.81 PTGER4 (0.48) PHGDHPTGER4PTGDRPTGER2
SCHEMBL18435242 0.81 PTGER4 (0.64) PHGDHPTGER4PTGER2
SCHEMBL12585876 0.81 PTGER4 (0.64) PHGDHPTGER4PTGER2
SCHEMBL12585327 0.80 PTGER4 (0.56) PHGDHPTGER4PTGDRPTGER2
SCHEMBL12584531 0.80 CYP1A2 (0.47) PHGDHPTGER4PTGDR
SCHEMBL12585471 0.78 PTGER4 (0.59) PHGDHPTGER4PTGDRPTGER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 EP disclosed
WO-2009139373-A1 AMIDE COMPOUND アステラス製薬株式会社 (JP) 2009-11-19 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-20110144153-A1 AMIDE COMPOUND PTGER4, PTGER1, PTGER2 PHGDH 3121/4885PTGER4 1/4885PTGDR 13/4885

“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.