SCHEMBL19158615

SCHEMBL19158615

N#C/N=C(\NCC(NC(=O)c1c(Cl)cc2c(c1Cl)CCN(C(=O)c1cn3cccc(O)c3n1)C2)C(=O)O)N1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ITGB2 P05107 20/20 0.51
▸ ICAM1 P05362 20/20 0.51
▸ ITGAL P20701 20/20 0.51

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
SCHEMBL23153571 1.00 ITGB2 (0.51) ITGB2ICAM1ITGAL
SCHEMBL4756099 0.92 ITGB2 (0.48) ITGB2ICAM1ITGAL
SCHEMBL17992455 0.92 ITGB2 (0.48) ITGB2ICAM1ITGAL
SCHEMBL12169792 0.92 ITGB2 (0.48) ITGB2ICAM1ITGAL
SCHEMBL17991436 0.91 ITGB2 (0.48) ITGB2ICAM1ITGAL
SCHEMBL12188704 0.84 ITGB2 (0.51) ITGB2ICAM1ITGAL
SCHEMBL18362298 0.84 ITGB2 (0.52) ITGB2ICAM1ITGAL
SCHEMBL19157595 0.84 ITGB2 (0.63) ITGB2ICAM1ITGAL
SCHEMBL22296881 0.84 ITGB2 (0.63) ITGB2ICAM1ITGAL
SCHEMBL4755927 0.84 ITGB2 (0.63) ITGB2ICAM1ITGAL

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
EP-3195861-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DRY EYE DISORDERS SARcode Bioscience Inc. (US) 2017-07-26 — — EP disclosed
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