SCHEMBL7682386

SCHEMBL7682386

CC(C)(C)[C@@H]1CC(=O)N1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
RIPK1 Q13546 2/20 0.38
ITGB1 P05556 3/20 0.33
ITGA5 P08648 3/20 0.33
MAPT P10636 1/20 0.32
MT-CO2 P00403 1/20 0.32
ALOX5 P09917 1/20 0.32
ITGB3 P05106 1/20 0.30
ITGAV P06756 1/20 0.30
ITGA4 P13612 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
SCHEMBL7682384 1.00 POLB (0.39) POLBRIPK1ITGB1ITGA5MAPT
SCHEMBL10642382 0.72 L3MBTL1 (0.41) POLB
SCHEMBL28908821 0.71 MEN1 (0.40)
SCHEMBL20471528 0.67 AR (0.34) POLBRIPK1ITGB1ITGA5MAPT
SCHEMBL3336957 0.67 AR (0.34) POLBRIPK1ITGB1ITGA5MAPT
SCHEMBL22978565 0.67 AR (0.34) POLBRIPK1ITGB1ITGA5MAPT
SCHEMBL3607555 0.67 AR (0.34) POLBRIPK1ITGB1ITGA5MAPT
SCHEMBL20835810 0.66 ACE (0.33)
SCHEMBL25489357 0.66 CHRM2 (0.38) POLBMAPT
SCHEMBL28898088 0.64 ACE (0.38) POLBRIPK1ITGB1ITGA5

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-1021405-B1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF HCMV INFECTIONS BOEHRINGER INGELHEIM CA LTD (CA) 2002-09-25 EP disclosed
US-6242439-B1 Azetidinone derivatives for the treatment of HCMV infections BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2001-06-05 US disclosed