SCHEMBL8524536

SCHEMBL8524536

CS(=O)(=O)c1cc(-n2cncn2)ccc1C(=O)c1cnoc1C1CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.38
F9 P00740 2/20 0.34
GPR119 Q8TDV5 1/20 0.34
SYK P43405 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KAT7 O95251 1/20 0.34
KAT6A Q92794 1/20 0.34
KAT5 Q92993 1/20 0.34
KAT8 Q9H7Z6 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DPP4 P27487 1/20 0.33
HSD11B1 P28845 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CTSS P25774 1/20 0.33

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
SCHEMBL8491301 0.86 F9 (0.42) PDE2AF9GPR119SYKMEN1
SCHEMBL8492423 0.83 PDE2A (0.38) PDE2AF9GPR119SYKSLC6A2
SCHEMBL8524146 0.82 DHODH (0.38) PDE2AF9GPR119SYKHSD11B1
SCHEMBL8524449 0.82 PDE2A (0.39) PDE2AF9GPR119SYKMEN1
SCHEMBL677644 0.79 DHODH (0.36) PDE2AKMT2ASMYD3
SCHEMBL8493300 0.79 DHODH (0.36) PDE2AALDH1A1SMN1; SMN2
SCHEMBL8491452 0.78 DHODH (0.37) PDE2A
SCHEMBL6054844 0.78 DHODH (0.35) PDE2AALDH1A1
SCHEMBL123795 0.78 F10 (0.39) PDE2AKMT2ASMN1; SMN2
SCHEMBL4894785 0.78 F10 (0.39) PDE2AKMT2ASMN1; SMN2

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-1999003856-A1 4-BENZOYL-ISOXAZOLE- AND -PYRAZOLE DERIVATIVES AND 2-CYANO 1,3-DIONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LIMITED (GB) 1999-01-28 WO disclosed