SCHEMBL5215418

SCHEMBL5215418

Cc1ccccc1C(C)C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.42
APP P05067 1/20 0.39
GLS O94925 2/20 0.38
ABCB1 P08183 1/20 0.38
AAK1 Q2M2I8 1/20 0.38
ACP3 P15309 1/20 0.38
ITGA4 P13612 1/20 0.37
ITGB7 P26010 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36

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
SCHEMBL14721160 1.00 ESR1 (0.42) ESR1APPGLSABCB1AAK1
SCHEMBL7746373 0.84 GABRA1 (0.47) APPAAK1ITGA4ITGB7LMNA
SCHEMBL16410353 0.83 APP (0.37) APPABCB1AAK1LMNAKMT2A
SCHEMBL16811751 0.83 ITGA4 (0.47) GLSITGA4ITGB7LMNAKMT2A
SCHEMBL29348332 0.80 HTT (0.37) APPAAK1LMNAKMT2AMAPK1
SCHEMBL16782681 0.80 MEN1 (0.46) LMNAKMT2AALDH1A1ADRB2ADRB1
SCHEMBL5216247 0.80 ITGA4 (0.40) APPABCB1AAK1ITGA4ITGB7
SCHEMBL29348334 0.80 APP (0.36) APPAAK1LMNAKMT2AL3MBTL1
SCHEMBL16782680 0.80 MEN1 (0.46) LMNAKMT2AALDH1A1ADRB2ADRB1
SCHEMBL6017451 0.79 KMT2A (0.47) ESR1GLSACP3KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1276732-B1 AMIDES OF R-2-(AMINOARYL)-PROPIONIC ACIDS FOR USE IN THEPREVENTION OF LEUCOCYTE ACTIVATION\ DOMPE PHA R MA SPA RES & MFG (IT) 2007-09-26 EP disclosed
US-7217707-B2 Amide of R-2-(aminoaryl)-propionic acid for use in the prevention of leucocyte activation DOMPE S.P.A. (IT) 2007-05-15 US disclosed
US-20040186146-A1 Amide of r-2-(aminoaryl)-propionic acid for use in theprevention of leucocyte activation DOMPÉ FARMACEUTICI S.P.A. (IT) 2004-09-23 US disclosed
EP-1276732-A1 AMIDES OF R-2-(AMINOARYL)-PROPIONIC ACIDS FOR USE IN THEPREVENTION OF LEUCOCYTE ACTIVATION\ Dompé S.P.A. (IT) 2003-01-22 EP disclosed
WO-2001079189-A2 'AMIDES OF R-2-(AMINOARYL)-PROPIONIC ACIDS FOR USE IN THEPREVENTION OF LEUCOCYTE ACTIVATION' Dompé S.p.A. (IT) 2001-10-25 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-20040186146-A1 Amide of r-2-(aminoaryl)-propionic acid for use in theprevention of leucocyte activation MMP8, CXCL8, HCAR2 ESR1 4416/4885APP 2281/4885GLS 303/4885

“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.