SCHEMBL9117375

SCHEMBL9117375

COC(=O)c1ccc2sc(C(=O)OC)c(OC)c2c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
MAPK1 P28482 2/20 0.39
MAPT P10636 6/20 0.38
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 4/20 0.38
GAA P10253 3/20 0.38
HPGD P15428 3/20 0.38
GLA P06280 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
ABL1 P00519 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
PDK2 Q15119 1/20 0.37
PDK4 Q16654 1/20 0.37

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
SCHEMBL7470966 0.86 BACE1 (0.38) MAPTKDM4EALDH1A1HPGDMEN1
SCHEMBL7470648 0.84 PDK2 (0.41) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL9116067 0.81 MCL1 (0.44) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL18529866 0.78 ABL1 (0.49) LMNAMAPTKDM4EALDH1A1GAA
SCHEMBL7471683 0.75 MAPK1 (0.34) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL4072002 0.75 ALDH1A1 (0.50) LMNAMAPTKDM4EALDH1A1GAA
SCHEMBL7464408 0.72 TDP1 (0.40) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL6185512 0.72 CHEK1 (0.43) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL1976165 0.72 ABL1 (0.44) LMNAMAPTKDM4EALDH1A1GAA
SCHEMBL523584 0.72 ABL1 (0.57) LMNAMAPTKDM4EALDH1A1GAA

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
WO-1995025105-A1 ISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD (GB) 1995-09-21 WO disclosed