SCHEMBL8211344

SCHEMBL8211344

CNC(=O)C1CC(OS(C)(=O)=O)CN1C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.43
CYP1A2 P05177 1/20 0.42
POLB P06746 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
MCL1 Q07820 12/20 0.39
HTRA1 Q92743 1/20 0.38
HSD11B1 P28845 1/20 0.37
MMP2 P08253 1/20 0.36
ANPEP P15144 1/20 0.36
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
F13A1 P00488 1/20 0.34
TGM2 P21980 1/20 0.34
TGM1 P22735 1/20 0.34

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
SCHEMBL1154972 0.86 MMP2 (0.48) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL489252 0.86 MMP2 (0.48) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL5058842 0.86 MMP2 (0.48) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL2252585 0.86 MMP2 (0.48) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL699280 0.86 MMP2 (0.48) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL7805563 0.86 MMP2 (0.48) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL5691732 0.86 MMP2 (0.48) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL4418512 0.85 HSD17B10 (0.38) CYP1A2POLBCYP3A4CYP2C19MCL1
SCHEMBL8609251 0.85 MMP2 (0.40) PTPN1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL7143154 0.85 HSD17B10 (0.38) CYP1A2POLBCYP3A4CYP2C19MCL1

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-1054865-A1 FARNESYL TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-11-29 EP disclosed
WO-1999041235-A1 FARNESYL TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed