SCHEMBL4014415

SCHEMBL4014415

O=C(O)c1ccc(CNC(=O)c2cc(Cl)ccc2OCCc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.64
KMT2A Q03164 1/20 0.54
AKR1C3 P42330 2/20 0.54
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.52
PTGER2 P43116 2/20 0.52
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
HPGD P15428 2/20 0.48
MAPT P10636 1/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.48
ATM Q13315 1/20 0.48
TUBB P07437 1/20 0.47
PTGER1 P34995 1/20 0.47

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
SCHEMBL4014358 0.96 PTGER4 (0.67) PTGER4KMT2AAKR1C3ALDH1A1LMNA
SCHEMBL4013417 0.93 PTGER4 (0.76) PTGER4KMT2AAKR1C3LMNAPTGER2
SCHEMBL4014975 0.90 PTGER4 (0.60) PTGER4KMT2AAKR1C3ALDH1A1LMNA
SCHEMBL1154066 0.89 AKR1C3 (0.55) PTGER4KMT2AAKR1C3LMNANPC1
SCHEMBL692054 0.88 PTGER4 (0.58) PTGER4KMT2AAKR1C3ALDH1A1LMNA
SCHEMBL27653404 0.87 PTGER4 (0.69) PTGER4KMT2AALDH1A1LMNAPTGER2
SCHEMBL2242766 0.84 PTGER4 (0.66) PTGER4KMT2AAKR1C3ALDH1A1LMNA
SCHEMBL11464602 0.82 PTGER4 (0.69) PTGER4KMT2AALDH1A1LMNAPTGER2
SCHEMBL4013089 0.81 PTGER4 (0.55) PTGER4AKR1C3LMNAPTGER2NPC1
SCHEMBL1153667 0.80 AKR1C3 (0.53) PTGER4KMT2AAKR1C3LMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756043-B1 ORTHO SUBSTITUTED ARYL OR HETEROARYL AMIDE COMPOUNDS RAQUALIA PHARMA INC (JP) 2009-07-01 EP disclosed
EP-1756043-B1 ORTHO SUBSTITUTED ARYL OR HETEROARYL AMIDE COMPOUNDS RAQUALIA PHARMA INC (JP) 2009-07-01 EP disclosed
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PFIZER, INC. 2009-02-05 US disclosed
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PFIZER, INC. 2009-02-05 US disclosed
CN-1950334-A Ortho substituted aryl or heteroaryl amide compounds PFIZER (US) 2007-04-18 CN disclosed
US-20050250818-A1 Ortho substituted aryl or heteroaryl amide compounds PFIZER INC 2005-11-10 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 (2 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-20050250818-A1 Ortho substituted aryl or heteroaryl amide compounds OPRL1, PTGER1, OPRM1 PTGER4 19/4885KMT2A 1543/4885AKR1C3 321/4885
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PTGER4, PTGER2, OPRL1 PTGER4 1/4885KMT2A 2227/4885AKR1C3 1975/4885

“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.