SCHEMBL12068855

SCHEMBL12068855

C[C@@]1(OCc2ccccc2)C[C@@H](COCc2ccccc2)O[C@@]1(O)c1ccc2c(N)nc(N)nn12

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.32
▸ HSPA5 P11021 1/20 0.31
▸ LMNA P02545 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
SCHEMBL13667489 0.86 TNK2 (0.38) TAAR1HSPA5
SCHEMBL10142663 0.80 HSPA5 (0.34) HSPA5
SCHEMBL12835935 0.77 HSPA5 (0.31) HSPA5
SCHEMBL19997435 0.75 DCPS (0.30) —
SCHEMBL13667763 0.74 PTPN1 (0.38) HSPA5
SCHEMBL23278056 0.71 HSPA5 (0.32) HSPA5
SCHEMBL19997429 0.67 HSPA5 (0.35) HSPA5
SCHEMBL2374198 0.67 HSPA5 (0.35) HSPA5
SCHEMBL12243232 0.67 HSPA5 (0.35) HSPA5
SCHEMBL19088037 0.67 HSPA5 (0.36) HSPA5

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-2011150288-A1 1'-SUBSTITUTED-CARBA-NUCLEOSIDE PRODRUGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2011-12-01 — — WO disclosed
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