SCHEMBL1345174

SCHEMBL1345174

C[C@@H](C(=O)O)c1cccc(CC2CCCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 2/20 0.46
▸ LTB4R2 Q9NPC1 2/20 0.46
▸ PTGS1 P23219 11/20 0.46
▸ PTGS2 P35354 11/20 0.46
▸ MT-CO1 P00395 1/20 0.46
▸ MT-CO2 P00403 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ CXCR1 P25024 2/20 0.46
▸ CXCR2 P25025 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ SLC22A6 Q4U2R8 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46

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
SCHEMBL8591229 0.93 LTB4R (0.49) LTB4RLTB4R2PTGS1PTGS2MT-CO1
SCHEMBL1345176 0.82 PTGS1 (0.65) PTGS1PTGS2MT-CO1MT-CO2CXCR1
SCHEMBL9063258 0.82 PTGS1 (0.65) PTGS1PTGS2MT-CO1MT-CO2CXCR1
SCHEMBL16191538 0.82 EED (0.40) ALDH1A1
SCHEMBL24307189 0.81 PTGS1 (0.67) PTGS1PTGS2MT-CO1MT-CO2CXCR1
SCHEMBL9063786 0.81 PTGS1 (0.67) PTGS1PTGS2MT-CO1MT-CO2CXCR1
SCHEMBL8590234 0.78 PTGS1 (0.51) LTB4RLTB4R2PTGS1PTGS2MT-CO2
SCHEMBL28780509 0.76 LTB4R (0.43) LTB4RLTB4R2PTGS1PTGS2MT-CO1
SCHEMBL11195436 0.76 PTGS1 (0.47) PTGS1PTGS2MT-CO1MT-CO2FAAH
SCHEMBL11189116 0.76 PTGS1 (0.47) PTGS1PTGS2MT-CO1MT-CO2FAAH

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
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-20050038119-A1 2-Aryl-propionic acids and pharmaceutical compositions containing them DOMPÉ FARMACEUTICI S.P.A. (IT) 2005-02-17 — — 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-20050038119-A1 2-Aryl-propionic acids and pharmaceutical compositions containing them CXCR2, FPR1, CCR2 LTB4R 81/4885LTB4R2 50/4885PTGS1 88/4885

“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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