SCHEMBL5201987

SCHEMBL5201987

CCCOc1ccc(CC2(C)C(=O)N(c3cc(Cl)nc(Cl)c3)C(=O)N2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 17/20 0.55
ICAM1 P05362 17/20 0.55
ITGAL P20701 17/20 0.55
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
KDM4A O75164 1/20 0.37
USP2 O75604 1/20 0.37
POLB P06746 1/20 0.37
ALOX15 P16050 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 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
SCHEMBL5201590 0.92 ITGB2 (0.57) ITGB2ICAM1ITGAL
SCHEMBL5239341 0.82 ITGAL (0.80) ITGB2ICAM1ITGAL
SCHEMBL5204304 0.82 ITGB2 (0.62) ITGB2ICAM1ITGAL
SCHEMBL5200790 0.82 ITGAL (0.58) ITGB2ICAM1ITGAL
SCHEMBL5203590 0.72 ITGAL (1.00) ITGB2ICAM1ITGAL
SCHEMBL7970387 0.68 ITGAL (0.57) ITGB2ICAM1ITGAL
SCHEMBL5201254 0.61 ITGAL (0.61) ITGB2ICAM1ITGAL
SCHEMBL2417808 0.60 LMNA (0.53) L3MBTL1ALDH1A1MAPT
SCHEMBL18884091 0.59 RAB9A (0.47) L3MBTL1POLBALDH1A1MAPT
SCHEMBL26024106 0.59 POLB (0.44) POLBMAPT

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-1284973-B1 INHIBITORS OF ALPHA L BETA 2 MEDIATED CELL ADHESION TANABE SEIYAKU CO (JP) 2007-06-27 EP claimed
US-6699888-B2 ANTIINFLAMMATORY TANABE SEIYAKU CO., LTD. (JP) 2004-03-02 US claimed
US-20030225138-A1 Inhibitors of alpha l beta 2 mediated cell adhesion TANABE SEIYAKU CO., LTD. (JP) 2003-12-04 US claimed
EP-1284973-B1 INHIBITORS OF ALPHA L BETA 2 MEDIATED CELL ADHESION TANABE SEIYAKU CO (JP) 2007-06-27 EP disclosed
US-6699888-B2 ANTIINFLAMMATORY TANABE SEIYAKU CO., LTD. (JP) 2004-03-02 US disclosed
US-20030225138-A1 Inhibitors of alpha l beta 2 mediated cell adhesion TANABE SEIYAKU CO., LTD. (JP) 2003-12-04 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-20030225138-A1 Inhibitors of alpha l beta 2 mediated cell adhesion ICAM1, VCAM1, SELL ITGB2 5/4885ICAM1 1/4885ITGAL 13/4885

“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.