SCHEMBL8891679

SCHEMBL8891679

CS(=O)(=O)c1ccccc1Cc1ccccc1C(=O)C(C#N)C(=O)C1CC1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.36
SLC6A2 P23975 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
LMNA P02545 3/20 0.32
BCAT2 O15382 1/20 0.32
POLB P06746 1/20 0.32
F10 P00742 1/20 0.32
HSD11B1 P28845 1/20 0.31
DPP4 P27487 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
CNR2 P34972 4/20 0.31
CDK2 P24941 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
SCHEMBL8605907 0.87 BCAT2 (0.40) JAK2JAK1TYK2LMNABCAT2
SCHEMBL8890879 0.84 DPP4 (0.37) LMNAHSD11B1DPP4CYP3A4CYP2C19
SCHEMBL8901366 0.81 SCN1A (0.42) POLBMEN1KMT2A
SCHEMBL8890858 0.81 SLC6A2 (0.36) SLC6A2LMNAPOLBMEN1KMT2A
SCHEMBL8609001 0.80 TSHR (0.37) LMNAPOLBCYP1A2CYP3A4CYP2D6
SCHEMBL8606989 0.80 LMNA (0.35) LMNAPOLBKMT2ACDK2
SCHEMBL8891322 0.80
SCHEMBL8815651 0.75 TSHR (0.32) LMNAMEN1KMT2A
SCHEMBL8606856 0.74 NR1I2 (0.32) LMNAMEN1CYP2D6KMT2A
SCHEMBL8196089 0.74 WDR5 (0.33) LMNA

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-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed