SCHEMBL18486233

SCHEMBL18486233

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(-c5cccc(CCCC(=O)O)c5)ncnc43)C[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TYMP P19971 4/20 0.36
DNPH1 O43598 7/20 0.34

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
SCHEMBL18486396 0.97 TYMP (0.36) TYMPDNPH1
SCHEMBL19689067 0.95 TYMP (0.35) TYMPDNPH1
SCHEMBL19689070 0.94 TYMP (0.35) TYMPDNPH1
SCHEMBL18486305 0.91 DNPH1 (0.40) TYMPDNPH1
SCHEMBL19689075 0.90 DNPH1 (0.42) TYMPDNPH1
SCHEMBL19689069 0.87 TYMP (0.38) TYMPDNPH1
SCHEMBL15301771 0.84 TYMP (0.41) TYMP
SCHEMBL18486225 0.83 TYMP (0.37) TYMP
SCHEMBL18486210 0.83 GAPDH (0.37) TYMP
SCHEMBL2054229 0.83 TYMP (0.39) TYMP

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-3130597-A1 OLIGONUCLEOTIDE HAVING NON-NATURAL NUCLEOTIDE AT 5'-TERMINAL THEREOF Kyowa Hakko Kirin Co., Ltd. (JP) 2017-02-15 EP disclosed