SCHEMBL13813625

SCHEMBL13813625

COC1=C(c2cc(C)cc(Cl)c2)S(=O)(=O)N2C[C@H](O)C[C@@]12Cc1ccc(Br)cc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 2/20 0.31
ITGB2 P05107 1/20 0.31
ICAM1 P05362 1/20 0.31

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
SCHEMBL13822009 0.95 ITGAL (0.34) ITGALITGB2ICAM1
SCHEMBL3385514 0.78 ITGAL (0.33) ITGALITGB2ICAM1
SCHEMBL14025846 0.76 ITGAL (0.37) ITGALITGB2ICAM1
SCHEMBL14025847 0.68 ITGAL (0.31) ITGALITGB2ICAM1
SCHEMBL4638373 0.65 ITGAL (0.36) ITGALITGB2ICAM1
SCHEMBL4638112 0.65 ITGAL (0.36) ITGALITGB2ICAM1
SCHEMBL4849619 0.65 ITGAL (0.38) ITGALITGB2ICAM1
SCHEMBL4849625 0.65 ITGAL (0.38) ITGALITGB2ICAM1
SCHEMBL4797185 0.65 ITGAL (0.38) ITGALITGB2ICAM1
SCHEMBL4917004 0.63 CCR5 (0.36) ITGALITGB2ICAM1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160220702-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY SARCODE BIOSCIENCE INC. (US) 2016-08-04 US disclosed
US-20090155176-A1 Compositions and methods for treatment of diabetic retinopathy SARCODE CORPORATION (US) 2009-06-18 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 (2 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-20090155176-A1 Compositions and methods for treatment of diabetic retinopathy VCAM1, ITGB1, ICAM1 ITGAL 5/4885ITGB2 11/4885ICAM1 3/4885
US-20160220702-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY VCAM1, ITGB1, ICAM1 ITGAL 5/4885ITGB2 11/4885ICAM1 3/4885

“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.