SCHEMBL5867258

SCHEMBL5867258

COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1C1=CC=C(C)OC1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 20/20 0.60
IMPDH1 P20839 15/20 0.60

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
SCHEMBL5867257 0.91 IMPDH2 (0.58) IMPDH2IMPDH1
SCHEMBL5867242 0.90 IMPDH2 (0.49) IMPDH2IMPDH1
SCHEMBL5867201 0.89 IMPDH2 (0.48) IMPDH2IMPDH1
SCHEMBL5867189 0.88 IMPDH2 (0.48) IMPDH2IMPDH1
SCHEMBL5867299 0.88 IMPDH2 (0.51) IMPDH2IMPDH1
SCHEMBL5867202 0.88 IMPDH2 (0.48) IMPDH2IMPDH1
SCHEMBL5867280 0.86 IMPDH2 (0.46) IMPDH2IMPDH1
SCHEMBL5867266 0.85 IMPDH2 (0.45) IMPDH2IMPDH1
SCHEMBL5867277 0.85 IMPDH2 (0.44) IMPDH2IMPDH1
SCHEMBL5867214 0.84 IMPDH2 (0.45) IMPDH2IMPDH1

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
US-7060720-B2 Inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB CO. (US) 2006-06-13 US disclosed