SCHEMBL6783391

SCHEMBL6783391

CC(=O)O[C@@H]1C(=O)N[C@@H]1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
ALOX5 P09917 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 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
SCHEMBL6327949 1.00 POLB (0.39) POLBALOX5ALDH1A1MEN1KMT2A
SCHEMBL9358907 0.74 POLB (0.38) POLBALDH1A1MEN1KMT2ACTSL
SCHEMBL27613087 0.73
SCHEMBL8829761 0.72 CTSL (0.41) POLBALDH1A1MEN1KMT2ACTSL
SCHEMBL6095759 0.70 POLB (0.42) POLBALOX5ALDH1A1MEN1KMT2A
SCHEMBL1568140 0.70 POLB (0.42) POLBALOX5ALDH1A1MEN1KMT2A
SCHEMBL12398491 0.69 CTSK (0.34) POLBALOX5CTSLCTSBCTSS
SCHEMBL4055842 0.69 POLB (0.35) POLBALDH1A1MEN1KMT2A
SCHEMBL14142750 0.69 POLB (0.35) POLBALDH1A1MEN1KMT2A
SCHEMBL4183134 0.69

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
EP-1251846-B1 C-4 CARBONATE TAXANES BRISTOL MYERS SQUIBB CO (US) 2004-08-11 EP disclosed
US-6750246-B1 NOVEL ORALLY ACTIVE PACLITAXEL DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY 2004-06-15 US disclosed