SCHEMBL4019571

SCHEMBL4019571

O=C(O)c1ccc(CNC(=O)c2cc(Cl)ccc2O)cc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TUBB P07437 2/20 0.63
P2RX1 P51575 1/20 0.61
TMPRSS4 Q9NRS4 1/20 0.61
PTGER4 P35408 2/20 0.61
EPHX2 P34913 2/20 0.58
ALDH1A1 P00352 2/20 0.55
CDK1 P06493 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
POLA1 P09884 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
HSP90AA1 P07900 1/20 0.53
PTGER2 P43116 1/20 0.52
NR1H4 Q96RI1 2/20 0.51
TOP2A P11388 1/20 0.51

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
SCHEMBL23675446 0.90 TUBB (0.72) TUBBP2RX1TMPRSS4ALDH1A1CDK1
SCHEMBL16127852 0.87 PTGER4 (0.62) PTGER4EPHX2ALDH1A1HPGDCA1
SCHEMBL16127858 0.87 PTGER4 (0.62) PTGER4EPHX2ALDH1A1HPGDCA1
SCHEMBL13236587 0.87 TUBB (0.75) TUBBP2RX1TMPRSS4ALDH1A1CDK1
SCHEMBL30100461 0.87 TUBB (0.75) TUBBP2RX1TMPRSS4ALDH1A1CDK1
SCHEMBL13812818 0.85 TUBB (0.69) TUBBP2RX1TMPRSS4EPHX2ALDH1A1
SCHEMBL13812639 0.84 P2RX1 (0.66) TUBBP2RX1TMPRSS4PTGER4CDK1
SCHEMBL26097052 0.84 HPGD (0.63) TUBBP2RX1TMPRSS4ALDH1A1CDK1
SCHEMBL16088675 0.84 PTGER4 (0.58) PTGER4EPHX2ALDH1A1HPGDCA1
SCHEMBL16088646 0.84 PTGER4 (0.58) PTGER4EPHX2ALDH1A1HPGDCA1

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
WO-2005102389-A9 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2009-04-30 WO disclosed
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PFIZER, INC. 2009-02-05 US disclosed
EP-1756043-A1 ORTHO SUBSTITUTED ARYL OR HETEROARYL AMIDE COMPOUNDS Pfizer, Inc. (US) 2007-02-28 EP disclosed
US-20050250818-A1 Ortho substituted aryl or heteroaryl amide compounds PFIZER INC 2005-11-10 US disclosed
WO-2005105733-A1 ORTHO SUBSTITUTED ARYL OR HETEROARYL AMIDE COMPOUNDS PFIZER JAPAN INC. (JP) 2005-11-10 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 (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 TUBB 4203/4885P2RX1 110/4885TMPRSS4 4748/4885
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PTGER4, PTGER2, OPRL1 TUBB 2267/4885P2RX1 37/4885TMPRSS4 632/4885

“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.