SCHEMBL14005196

SCHEMBL14005196

BB[C@H]1CC(OP(OCCC#N)N(C(C)C)C(C)C)[C@@H](COC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)O1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 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
SCHEMBL24829632 0.91 TYMP (0.32) TYMP
SCHEMBL25747161 0.91 TYMP (0.32) TYMP
SCHEMBL13329991 0.90 TYMP (0.32) TYMP
SCHEMBL13374809 0.90 TYMP (0.32) TYMP
SCHEMBL12765859 0.90 TYMP (0.32) TYMP
SCHEMBL14064222 0.89 TYMP (0.31) TYMP
SCHEMBL13010078 0.85 — —
SCHEMBL6854140 0.84 SLC6A1 (0.33) TYMP
SCHEMBL27094916 0.84 SLC6A1 (0.33) TYMP
SCHEMBL26270123 0.84 SLC6A1 (0.33) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7446186-B2 Pyrroles substituted by oligonucleotides BIOMERIEUX (FR) 2008-11-04 — — US disclosed
US-7301041-B2 Bi-functional metallocenes, preparation process and use in the labeling or biological molecules BIO MERIEUX (FR) 2007-11-27 — — US disclosed
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