SCHEMBL17130417

SCHEMBL17130417

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

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.37
▸ DOT1L Q8TEK3 3/20 0.35

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
SCHEMBL17106845 1.00 POLRMT (0.37) POLRMTDOT1L
SCHEMBL17114380 0.90 POLRMT (0.36) POLRMTDOT1L
SCHEMBL17111232 0.90 POLRMT (0.36) POLRMTDOT1L
SCHEMBL17106697 0.90 POLRMT (0.36) POLRMTDOT1L
SCHEMBL19412426 0.89 POLRMT (0.34) POLRMTDOT1L
SCHEMBL17106779 0.84 SLC28A1 (0.30) —
SCHEMBL17106714 0.83 POLRMT (0.35) POLRMTDOT1L
SCHEMBL17106723 0.83 POLRMT (0.33) POLRMTDOT1L
SCHEMBL19412761 0.83 POLRMT (0.38) POLRMTDOT1L
SCHEMBL26270281 0.83 POLRMT (0.38) POLRMTDOT1L

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015148746-A1 4'-SUBSTITUTED NUCLEOSIDE-DERIVATIVES AS HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — WO disclosed
WO-2015143712-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — WO disclosed
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