SCHEMBL9014399

SCHEMBL9014399

Cc1cn([C@H]2C[C@](N)(O)[C@@H](C(O)C(c3ccccc3)(c3ccccc3)c3ccccc3)O2)c(=O)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NT5M Q9NPB1 1/20 0.43
TK1 P04183 6/20 0.42
RNASE1 P07998 1/20 0.41
TK2 O00142 2/20 0.39

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
SCHEMBL4580937 0.93 NT5M (0.41) NT5MTK1RNASE1
SCHEMBL7900375 0.82 TK1 (0.40) NT5MTK1RNASE1
SCHEMBL8591789 0.82 TK1 (0.44) NT5MTK1
SCHEMBL7249545 0.82 TK2 (0.39) NT5MTK1RNASE1TK2
SCHEMBL8931976 0.81 TK1 (0.38) NT5MTK1RNASE1
SCHEMBL8931975 0.80 TK1 (0.37) NT5MTK1RNASE1TK2
SCHEMBL29552415 0.79 TK1 (0.42) TK1TK2
SCHEMBL6066040 0.79 TK1 (0.45) NT5MTK1RNASE1TK2
SCHEMBL29703065 0.78 TK1 (0.36) NT5MTK1RNASE1TK2
SCHEMBL4626081 0.77 TK1 (0.55) TK1

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
US-5561225-A Polynucleotide analogs containing sulfonate and sulfonamide internucleoside linkages SOUTHERN RESEARCH INSTITUTE (US) 1996-10-01 US disclosed