SCHEMBL24058306

SCHEMBL24058306

Nc1ncnn2c([C@H]3CC[C@@H](CN=O)O3)ccc12

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.35
▸ DOT1L Q8TEK3 3/20 0.34
▸ MAP4K4 O95819 1/20 0.33
▸ TNIK Q9UKE5 1/20 0.31
▸ STING1 Q86WV6 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
SCHEMBL18667150 0.86 CYP2A6 (0.39) POLRMTDOT1LMAP4K4TNIKSTING1
SCHEMBL4970560 0.86 CYP2A6 (0.39) POLRMTDOT1LMAP4K4TNIKSTING1
SCHEMBL19344220 0.86 CYP2A6 (0.39) POLRMTDOT1LMAP4K4TNIKSTING1
SCHEMBL19344234 0.86 CYP2A6 (0.39) POLRMTDOT1LMAP4K4TNIK
SCHEMBL20834955 0.84 DOT1L (0.35) POLRMTDOT1LMAP4K4STING1
SCHEMBL24340458 0.81 POLRMT (0.43) POLRMTDOT1L
SCHEMBL22355531 0.81 POLRMT (0.43) POLRMTDOT1L
SCHEMBL24606310 0.81 DOT1L (0.36) POLRMTDOT1L
SCHEMBL24606327 0.80 DOT1L (0.34) POLRMTDOT1L
SCHEMBL23584543 0.80 MAP4K4 (0.36) POLRMTDOT1LMAP4K4STING1

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-3212175-B1 METHODS FOR THE PREPARATION OF RIBOSIDES GILEAD SCIENCES INC (US) 2021-11-24 — — EP disclosed
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