SCHEMBL12835935

SCHEMBL12835935

CSc1nc(N)c2ncc(C3(O)O[C@H](COCc4ccccc4)C[C@@]3(C)OCc3ccccc3)n2n1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 1/20 0.31

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
SCHEMBL12243146 0.83 HSPA5 (0.34) HSPA5
SCHEMBL12393303 0.78 — —
SCHEMBL19997395 0.77 — —
SCHEMBL19997428 0.77 — —
SCHEMBL12068855 0.77 TAAR1 (0.32) HSPA5
SCHEMBL10171929 0.76 NPC1 (0.35) —
SCHEMBL13667489 0.76 TNK2 (0.38) HSPA5
SCHEMBL12243220 0.75 PDE2A (0.32) HSPA5
SCHEMBL12393237 0.74 PDE2A (0.30) —
SCHEMBL12243144 0.74 PDE2A (0.30) —

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-2011035250-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF 1'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS GILEAD SCIENCES, INC. (US) 2011-03-24 — — WO disclosed
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