SCHEMBL13894076

SCHEMBL13894076

C[C@H](NC(=O)c1c(Cl)cc2c(c1Cl)CCN(C(=O)c1cc3ccccn3n1)C2)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ITGB2 P05107 19/20 0.72
▸ ICAM1 P05362 19/20 0.72
▸ ITGAL P20701 19/20 0.72
▸ HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL12063267 0.88 ITGB2 (0.74) ITGB2ICAM1ITGAL
SCHEMBL13894057 0.86 ITGB2 (0.59) ITGB2ICAM1ITGAL
SCHEMBL12169934 0.84 ITGB2 (0.68) ITGB2ICAM1ITGAL
SCHEMBL25912265 0.83 ITGB2 (0.67) ITGB2ICAM1ITGAL
SCHEMBL13894120 0.83 ITGB2 (0.55) ITGB2ICAM1ITGAL
SCHEMBL12054458 0.82 ITGB2 (0.76) ITGB2ICAM1ITGAL
SCHEMBL16851828 0.82 ITGB2 (0.76) ITGB2ICAM1ITGAL
SCHEMBL13894282 0.81 ITGB2 (0.65) ITGB2ICAM1ITGAL
SCHEMBL25912167 0.81 ITGB2 (0.65) ITGB2ICAM1ITGAL
SCHEMBL4756023 0.81 ITGB2 (0.64) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3167886-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF MACULAR EDEMA SARcode Bioscience Inc. (US) 2017-05-17 — — EP disclosed
EP-2209371-B1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY SARCODE BIOSCIENCE INC (US) 2017-01-04 — — EP disclosed
WO-2009054914-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY SARCODE CORPORATION (US) 2009-04-30 — — WO disclosed
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