SCHEMBL9012379

SCHEMBL9012379

CC(=O)OCC1C2CCC(O2)C1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 2/20 0.32
PTPN1 P18031 2/20 0.32
PPP1CC P36873 2/20 0.32
MAPT P10636 2/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
HPGD P15428 1/20 0.30
NLRP3 Q96P20 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
SCHEMBL9011957 0.81
SCHEMBL9674796 0.79
SCHEMBL9675731 0.78
SCHEMBL10997009 0.78
SCHEMBL9675736 0.78
SCHEMBL10996974 0.78
SCHEMBL9718260 0.77 TBXA2R (0.38)
SCHEMBL9675345 0.75
SCHEMBL9675340 0.75
SCHEMBL9718060 0.74 TBXA2R (0.34)

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-0743320-A2 Acyl guanidine and amidine prodrugs BRISTOL-MYERS SQUIBB COMPANY (US) 1996-11-20 EP disclosed