SCHEMBL6207399

SCHEMBL6207399

CC(C)(C)OC(=O)[C@@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPM1D O15297 1/20 0.31
UCHL1 P09936 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
SCHEMBL29548437 0.89 UCHL1 (0.37) UCHL1
SCHEMBL15130169 0.88 MMP2 (0.39) PPM1D
SCHEMBL3477748 0.86 ATM (0.36) PPM1D
SCHEMBL15203438 0.86 ATM (0.36) PPM1D
SCHEMBL3528010 0.86 ATM (0.36) PPM1D
SCHEMBL30729549 0.86 ATM (0.36) PPM1D
SCHEMBL30345061 0.86 ATM (0.36) PPM1D
SCHEMBL4330399 0.86 ATM (0.36) PPM1D
SCHEMBL22367414 0.83 PPM1D (0.34) PPM1D
SCHEMBL18548904 0.83 PPM1D (0.32) PPM1D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189612-A4 VLA-4 INHIBITOR COMPOUNDS DAIICHI SEIYAKU CO (JP) 2005-02-16 EP disclosed
EP-1189612-A1 VLA-4 INHIBITOR COMPOUNDS Daiichi Pharmaceutical Co., Ltd. (JP) 2002-03-27 EP disclosed
WO-2001000206-A1 VLA-4 INHIBITOR COMPOUNDS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-01-04 WO disclosed