SCHEMBL5694102

SCHEMBL5694102

C=CCOC(=O)Nc1nc(=O)n([C@H]2C[C@H](OP(=O)(OCC=C)OCCC#N)[C@@H](CO)O2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.36
▸ POLB P06746 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.32
▸ SMN1; SMN2 Q16637 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
SCHEMBL5694043 0.82 SLC29A1 (0.38) LMNA
SCHEMBL5908160 0.82 POLG (0.39) —
SCHEMBL5694044 0.78 POLG (0.38) POLB
SCHEMBL5694287 0.78 POLB (0.34) POLB
SCHEMBL5694161 0.77 LMNA (0.40) LMNASMN1; SMN2
SCHEMBL21539912 0.74 ALDH1A1 (0.45) LMNAPOLBKDM4E
SCHEMBL5908156 0.74 TYMS (0.42) LMNASMN1; SMN2
SCHEMBL5694113 0.74 POLB (0.42) LMNAPOLB
SCHEMBL5694389 0.74 DNMT1 (0.40) LMNAPOLB
SCHEMBL17860588 0.72 ADORA1 (0.40) POLB

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-1645561-A1 METHOD OF SYNTHESIZING CYCLIC BISDINUCLEOSIDE Mitsui Chemicals, Inc. (JP) 2006-04-12 — — EP disclosed
Send feedback