SCHEMBL13894233

SCHEMBL13894233

O=C(O)CNC(=O)c1c(Cl)cc2c(c1Cl)CCN(C(=O)c1ccc(Cl)s1)C2

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ITGB2 P05107 18/20 0.49
▸ ICAM1 P05362 18/20 0.49
▸ ITGAL P20701 18/20 0.49
▸ HDAC6 Q9UBN7 2/20 0.47

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
SCHEMBL13894069 0.83 ITGB2 (0.67) ITGB2ICAM1ITGALHDAC6
SCHEMBL13894281 0.80 ITGB2 (0.56) ITGB2ICAM1ITGALHDAC6
SCHEMBL13894108 0.77 ITGB2 (0.65) ITGB2ICAM1ITGALHDAC6
SCHEMBL13894078 0.77 ITGB2 (0.65) ITGB2ICAM1ITGALHDAC6
SCHEMBL13894118 0.77 HDAC6 (0.51) ITGB2ICAM1ITGALHDAC6
SCHEMBL13665376 0.77 ITGB2 (0.67) ITGB2ICAM1ITGAL
SCHEMBL13821871 0.75 ITGB2 (0.50) ITGB2ICAM1ITGALHDAC6
SCHEMBL4756097 0.75 ITGB2 (0.78) ITGB2ICAM1ITGAL
SCHEMBL13894068 0.75 HDAC6 (0.45) ITGB2ICAM1ITGALHDAC6
SCHEMBL13435928 0.74 ITGB2 (0.58) 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
WO-2009054914-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY SARCODE CORPORATION (US) 2009-04-30 — — WO disclosed
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