SCHEMBL5531245

SCHEMBL5531245

COc1cc(N=C(NC#N)Nc2ccccc2C)ccc1-c1cnco1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 20/20 0.73

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
SCHEMBL5529880 0.88 IMPDH2 (0.84) IMPDH2
SCHEMBL5532678 0.85 IMPDH2 (0.89) IMPDH2
SCHEMBL5614121 0.85 IMPDH2 (0.65) IMPDH2
SCHEMBL5613824 0.84 IMPDH2 (1.00) IMPDH2
SCHEMBL1473633 0.82 IMPDH2 (1.00) IMPDH2
SCHEMBL1473636 0.82 IMPDH2 (1.00) IMPDH2
SCHEMBL1473363 0.82 IMPDH2 (1.00) IMPDH2
SCHEMBL1473365 0.82 IMPDH2 (1.00) IMPDH2
SCHEMBL1474175 0.81 IMPDH2 (1.00) IMPDH2
SCHEMBL1474174 0.81 IMPDH2 (1.00) IMPDH2

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-2803357-B1 Angiogenesis inhibitors UNIV JOHNS HOPKINS (US) 2020-11-18 EP disclosed
EP-1765336-A2 ANGIOGENESIS INHIBITORS THE JOHNS-HOPKINS UNIVERSITY (US) 2007-03-28 EP disclosed
WO-2006004795-A2 ANGIOGENESIS INHIBITORS THE JOHNS HOPKINS UNIVERSITY (US) 2006-01-12 WO disclosed