SCHEMBL24360217

SCHEMBL24360217

COCOC(=O)[C@H](Cc1cccc(S(C)(=O)=O)c1)NC(=O)c1c(Cl)cc2c(c1Cl)CCNC2

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 20/20 0.54
ICAM1 P05362 20/20 0.54
ITGAL P20701 20/20 0.54
CYP2C9 P11712 1/20 0.49

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
Hydrochloric Acid SCHEMBL29547703 0.93 ITGB2 (0.55) ITGB2ICAM1ITGALCYP2C9
SCHEMBL13588337 0.91 ITGB2 (0.55) ITGB2ICAM1ITGALCYP2C9
SCHEMBL20833731 0.91 ITGB2 (0.55) ITGB2ICAM1ITGALCYP2C9
Hydrochloric Acid SCHEMBL28387762 0.90 ITGB2 (0.55) ITGB2ICAM1ITGALCYP2C9
Hydrochloric Acid SCHEMBL31021044 0.90 ITGB2 (0.55) ITGB2ICAM1ITGALCYP2C9
SCHEMBL19134129 0.90 ITGB2 (0.57) ITGB2ICAM1ITGALCYP2C9
SCHEMBL20903203 0.89 ITGB2 (0.66) ITGB2ICAM1ITGALCYP2C9
SCHEMBL15445340 0.89 ITGB2 (0.59) ITGB2ICAM1ITGALCYP2C9
SCHEMBL879313 0.89 ITGB2 (0.66) ITGB2ICAM1ITGALCYP2C9
Hydrochloric Acid SCHEMBL20680587 0.88 ITGB2 (0.65) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022084739-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF OCULAR DISORDERS Azura Ophthalmics Ltd. (IL) 2022-04-28 WO disclosed