SCHEMBL23369085

SCHEMBL23369085

CCOC1=NC(N=[N+]=[N-])=NN2C1=CCC=C2[C@@H]1O[C@@H]2C(OCc3ccccc3)C2(OCc2ccccc2)[C@H]1F

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 4/20 0.34

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
SCHEMBL18787327 0.69 BCHE (0.32) BCHE
SCHEMBL23047613 0.60 BCHE (0.38) BCHE
SCHEMBL19778888 0.58 — —
SCHEMBL19779077 0.58 — —
SCHEMBL20653922 0.58 PDE2A (0.32) —
SCHEMBL24158036 0.55 BCHE (0.44) BCHE
SCHEMBL19997427 0.55 BCHE (0.41) BCHE
SCHEMBL19292430 0.55 CTSV (0.38) BCHE
SCHEMBL19650285 0.53 MAPT (0.38) BCHE
SCHEMBL19779069 0.51 DOT1L (0.35) BCHE

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-3351552-B1 2'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES INC (US) 2021-05-19 — — EP disclosed
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