SCHEMBL881706

SCHEMBL881706

CO[C@@]1(c2ccc3c(N)ncnn23)O[C@H](CO)C[C@@]1(C)F

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 6/20 0.36
▸ POLRMT O00411 1/20 0.30

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
SCHEMBL881457 0.81 TMPRSS2 (0.34) RIPK1
SCHEMBL881450 0.81 ADORA2A (0.33) RIPK1POLRMT
SCHEMBL15682881 0.78 TMPRSS2 (0.35) POLRMT
SCHEMBL12243243 0.78 ADORA2A (0.36) POLRMT
SCHEMBL12393214 0.78 ADORA2A (0.36) POLRMT
SCHEMBL18697868 0.76 RIPK1 (0.31) RIPK1POLRMT
SCHEMBL10154383 0.75 RIPK1 (0.31) RIPK1POLRMT
SCHEMBL23047661 0.75 ACVRL1 (0.32) RIPK1POLRMT
SCHEMBL18666834 0.75 ACVRL1 (0.32) RIPK1POLRMT
SCHEMBL807536 0.75 ACVRL1 (0.32) RIPK1POLRMT

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-2012039787-A1 2' -FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-03-29 — — WO disclosed
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