SCHEMBL9850186

SCHEMBL9850186

CC(C)(C)[Si](OC[C@@H]1C[C@@H](F)[C@H](n2cnc3c(N)ncnc32)O1)(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 3/20 0.53
▸ NT5E P21589 4/20 0.50
▸ ADORA1 P30542 2/20 0.49
▸ AHCY P23526 4/20 0.43
▸ EGFR P00533 1/20 0.42
▸ ERBB2 P04626 1/20 0.42
▸ PI4KA P42356 1/20 0.40
▸ PI4K2B Q8TCG2 1/20 0.40
▸ PI4K2A Q9BTU6 1/20 0.40
▸ PI4KB Q9UBF8 1/20 0.40

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
SCHEMBL9850184 1.00 BCHE (0.53) BCHENT5EADORA1AHCYEGFR
SCHEMBL22206323 0.87 NT5E (0.66) NT5E
SCHEMBL20305252 0.87 NT5E (0.66) NT5E
SCHEMBL15948772 0.86 PRMT5 (0.41) BCHENT5EADORA1EGFR
SCHEMBL9850201 0.86 BCHE (0.54) BCHENT5EADORA1AHCYEGFR
SCHEMBL9850195 0.86 BCHE (0.54) BCHENT5EADORA1AHCYEGFR
SCHEMBL10436010 0.84 BCHE (0.52) BCHENT5EADORA1AHCYPI4KA
SCHEMBL10436009 0.84 BCHE (0.52) BCHENT5EADORA1AHCYPI4KA
SCHEMBL9850171 0.82 NT5E (0.66) NT5EADORA1PI4KAPI4K2BPI4K2A
SCHEMBL9850169 0.82 NT5E (0.66) NT5EADORA1PI4KAPI4K2BPI4K2A

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
EP-0428109-A2 Deoxyfluoronucleoside process Bristol-Myers Squibb Company (US) 1991-05-22 — — EP disclosed
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