Lifitegrast

Lifitegrast

SCHEMBL22556043

CS(=O)(=O)c1cccc(C[C@@H](NC(=O)c2c(Cl)cc3c(c2Cl)CCN(C(=O)c2ccc4ccoc4c2)C3)C(=O)O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ITGALITGB2

The experimentally established mechanism targets of Lifitegrast. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ITGB2 known ✓ P05107 20/20 1.00
▸ ITGAL known ✓ P20701 20/20 1.00
▸ ICAM1 P05362 20/20 1.00
▸ CYP2C9 P11712 1/20 1.00

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
Lifitegrast SCHEMBL2632068 1.00 ITGB2 (1.00) ITGB2ICAM1ITGALCYP2C9
Lifitegrast SCHEMBL31010393 1.00 ITGB2 (1.00) ITGB2ICAM1ITGALCYP2C9
Lifitegrast SCHEMBL29386183 1.00 ITGB2 (1.00) ITGB2ICAM1ITGALCYP2C9
Lifitegrast SCHEMBL29355715 1.00 ITGB2 (1.00) ITGB2ICAM1ITGALCYP2C9
Lifitegrast SCHEMBL13167919 1.00 ITGB2 (1.00) ITGB2ICAM1ITGALCYP2C9
SCHEMBL28561637 0.97 ITGB2 (0.95) ITGB2ICAM1ITGALCYP2C9
SCHEMBL15445331 0.96 ITGB2 (0.92) ITGB2ICAM1ITGALCYP2C9
SCHEMBL22929996 0.95 ITGB2 (0.90) ITGB2ICAM1ITGALCYP2C9
SCHEMBL19134124 0.95 ITGB2 (0.90) ITGB2ICAM1ITGALCYP2C9
SCHEMBL4756175 0.95 ITGB2 (0.90) ITGB2ICAM1ITGALCYP2C9

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-20230357207-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS BCP3 PTY LIMITED (AU) 2023-11-09 — — US disclosed
US-20210107899-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS Azura Ophthalmics Ltd. (IL) 2021-04-15 — — US disclosed
US-10875845-B2 Compounds and methods for the treatment of ocular disorders Azura Ophthalmics Ltd. (IL) 2020-12-29 — — US disclosed
US-20200331896-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS Azura Ophthalmics Ltd. (IL) 2020-10-22 — — 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 (4 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-20210107899-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS MUC1, MPO, SERPINB1 ITGB2 989/4885ITGAL 922/4885ICAM1 306/4885
US-20200331896-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS MUC1, MPO, SERPINB1 ITGB2 989/4885ITGAL 922/4885ICAM1 306/4885
US-20230357207-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS MUC1, MPO, SERPINB1 ITGB2 989/4885ITGAL 922/4885ICAM1 306/4885
US-10875845-B2 Compounds and methods for the treatment of ocular disorders MUC1, MPO, SERPINB1 ITGB2 989/4885ITGAL 922/4885ICAM1 306/4885

“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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