SCHEMBL12169926

SCHEMBL12169926

O=C(NC[C@H](NC(=O)c1c(Cl)cc2c(c1Cl)CCN(CCC(O)c1cccc(O)c1)C2)C(=O)O)c1cccs1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ITGAL P20701 20/20 0.65
▸ ITGB2 P05107 19/20 0.65
▸ ICAM1 P05362 19/20 0.65

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
SCHEMBL23176446 0.85 ITGAL (0.48) ITGALITGB2ICAM1
SCHEMBL13894114 0.85 ITGAL (0.48) ITGALITGB2ICAM1
SCHEMBL18867977 0.85 ITGAL (0.49) ITGALITGB2ICAM1
SCHEMBL17991461 0.84 ITGAL (0.76) ITGALITGB2ICAM1
SCHEMBL18868508 0.84 ITGAL (0.46) ITGALITGB2ICAM1
SCHEMBL23176604 0.84 ITGAL (0.46) ITGALITGB2ICAM1
SCHEMBL18868608 0.83 ITGAL (0.45) ITGALITGB2ICAM1
SCHEMBL13894065 0.83 ITGAL (0.48) ITGALITGB2ICAM1
SCHEMBL13813596 0.82 ITGAL (0.47) ITGALITGB2ICAM1
SCHEMBL13821870 0.82 ITGAL (0.46) ITGALITGB2ICAM1

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
US-20120232019-A1 Compositions and Methods for Treatment of Eye Disorders SARCODE BIOSCIENCE INC. (US) 2012-09-13 — — US disclosed
US-20120232019-A1 Compositions and Methods for Treatment of Eye Disorders SARCODE BIOSCIENCE INC. (US) 2012-09-13 — — US disclosed
US-20100092542-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF EYE DISORDERS CITIBANK, N.A., AS NOTES COLLATERAL AGENT 2010-04-15 — — US disclosed
US-20100092542-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF EYE DISORDERS CITIBANK, N.A., AS NOTES COLLATERAL AGENT 2010-04-15 — — 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 (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-20100092542-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF EYE DISORDERS ICAM1, VCAM1, ITGAL ITGAL 3/4885ITGB2 8/4885ICAM1 1/4885
US-20120232019-A1 Compositions and Methods for Treatment of Eye Disorders ICAM1, VCAM1, ITGAL ITGAL 3/4885ITGB2 8/4885ICAM1 1/4885

“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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