SCHEMBL6233074

SCHEMBL6233074

COc1cc(OCc2ccccc2F)cc(OC)c1CNCC(c1ccccc1)c1ncc(C)s1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 17/20 0.50
CTSA P10619 3/20 0.44

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
SCHEMBL6232102 0.88 CTSA (0.44) CD274CTSA
SCHEMBL6236047 0.83 CTSA (0.45) CD274CTSA
SCHEMBL6232680 0.81 CD274 (0.46) CD274
SCHEMBL6232677 0.81 CD274 (0.46) CD274
SCHEMBL6233373 0.74 CD274 (0.42) CD274CTSA
SCHEMBL6238954 0.72 BCHE (0.60)
SCHEMBL6233776 0.71 CD274 (0.45) CD274
SCHEMBL6236773 0.70 CTSA (0.41) CD274CTSA
SCHEMBL6232098 0.70 CD274 (0.40) CD274CTSA
SCHEMBL6232101 0.70 CD274 (0.40) CD274CTSA

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-2005000309-A2 CHEMICAL COMPOUNDS IONIX PHARMACEUTICALS LIMITED (GB) 2005-01-06 WO disclosed