SCHEMBL1344992

SCHEMBL1344992

CC(=O)c1cccc([C@@H](C)C(=O)O)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.72
PTGS2 P35354 5/20 0.72
MAPT P10636 2/20 0.72
CXCR1 P25024 2/20 0.72
CXCR2 P25025 2/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
ALDH1A1 P00352 2/20 0.72
SLC22A6 Q4U2R8 2/20 0.72
RECQL P46063 1/20 0.72
KDM4E B2RXH2 1/20 0.72
LMNA P02545 1/20 0.72
CYP3A4 P08684 1/20 0.72
HPGD P15428 1/20 0.72
MAPK1 P28482 1/20 0.72
PMP22 Q01453 1/20 0.72
HSD17B10 Q99714 1/20 0.72
CXCL8 P10145 1/20 0.72
THPO P40225 1/20 0.72
HIF1A Q16665 1/20 0.72
AKR1C3 P42330 6/20 0.58

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
SCHEMBL6717009 1.00 PTGS1 (0.72) PTGS1PTGS2MAPTCXCR1CXCR2
SCHEMBL1344993 1.00 PTGS1 (0.72) PTGS1PTGS2MAPTCXCR1CXCR2
SCHEMBL28999793 0.91 ALDH1A1 (0.59) PTGS1PTGS2MAPTCXCR1CXCR2
SCHEMBL27845336 0.87 ALDH1A1 (0.54) PTGS1PTGS2MAPTCXCR1CXCR2
SCHEMBL6469001 0.86 PTGS1 (0.68) PTGS1PTGS2MAPTCXCR1CXCR2
SCHEMBL1345165 0.86 PTGS2 (0.68) PTGS1PTGS2MAPTCXCR1CXCR2
Hydrogen Peroxide SCHEMBL9061056 0.85 RXRA (0.54) PTGS1PTGS2MAPTCXCR1CXCR2
Ketoprofen SCHEMBL28602451 0.84 PTGS1 (0.93) PTGS1PTGS2MAPTCXCR1CXCR2
SCHEMBL602096 0.84 PTGS2 (0.69) PTGS1PTGS2MAPTCXCR1CXCR2
Ketoprofen SCHEMBL8754790 0.84 PTGS1 (1.00) PTGS1PTGS2MAPTCXCR1CXCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229942-B1 2-Aryl-propionic acids and pharmaceutical compositions containing them DOMPE SPA (IT) 2012-08-29 EP disclosed
US-8063242-B2 for treatment of neutrofil-dependent pathologies such as psoriasis, ulcerative colitis, melanoma, chronic obstructive pulmonary disease (COPD), bollous pemphigo, rheumatoid arthritis, idiopathic fibrosis, glomerulonephritis; prevention and treatment of damages caused by ischemia and reperfusion DOMPE PHA.R.MA S.P.A. (IT) 2011-11-22 US disclosed
EP-2229942-A1 2-Aryl-propionic acids and pharmaceutical compositions containing them Dompe S.p.A. (IT) 2010-09-22 EP disclosed
US-7705050-B2 Amides, useful in the inhibition of IL-8-induced chemotaxis of neutrophils DOMPÉ FARMACEUTICI S.P.A. (IT) 2010-04-27 US disclosed
EP-1255726-B1 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS DOMPE PHA R MA SPA RES & MFG (IT) 2009-11-11 EP disclosed
US-20050038119-A1 2-Aryl-propionic acids and pharmaceutical compositions containing them DOMPÉ FARMACEUTICI S.P.A. (IT) 2005-02-17 US disclosed
US-20040181073-A1 Amides, useful in the inhibition of il-8-induced chemotaxis of neutrophils DOMPÉ FARMACEUTICI S.P.A. (IT) 2004-09-16 US disclosed
EP-1255726-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.P.A. (IT) 2002-11-13 EP disclosed
WO-2001058852-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8-INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.p.A. (IT) 2001-08-16 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-20040181073-A1 Amides, useful in the inhibition of il-8-induced chemotaxis of neutrophils CXCL8, MMP8, CCR8 PTGS1 171/4885PTGS2 219/4885MAPT 3584/4885
US-20050038119-A1 2-Aryl-propionic acids and pharmaceutical compositions containing them CXCR2, FPR1, CCR2 PTGS1 88/4885PTGS2 99/4885MAPT 4538/4885

“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.