SCHEMBL21423974

SCHEMBL21423974

CSn1cc(CNC(C)=O)nn1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.49
NPSR1 Q6W5P4 1/20 0.45
ALOX15 P16050 1/20 0.43
SETDB1 Q15047 5/20 0.39
MIF P14174 5/20 0.35
MALT1 Q9UDY8 1/20 0.35
KMT2A Q03164 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
GBA1 P04062 1/20 0.32

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
SCHEMBL16579400 0.78 NOTUM (0.52) NOTUMNPSR1ALOX15SETDB1MIF
SCHEMBL23011639 0.77 NOTUM (0.51) NOTUMNPSR1ALOX15SETDB1MIF
SCHEMBL19662980 0.75 NOTUM (0.50) NOTUMNPSR1ALOX15GBA1
SCHEMBL24556741 0.75 NOTUM (0.50) NOTUMNPSR1ALOX15SETDB1MIF
SCHEMBL25882774 0.75 NOTUM (0.47) NOTUMNPSR1ALOX15MALT1GBA1
SCHEMBL25884344 0.74 NOTUM (0.49) NOTUMNPSR1ALOX15GBA1
SCHEMBL22906161 0.74 NOTUM (0.49) NOTUMNPSR1ALOX15SETDB1
SCHEMBL7963203 0.74 NOTUM (0.49) NOTUMNPSR1ALOX15
SCHEMBL26318734 0.74 NOTUM (0.46) NOTUMNPSR1ALOX15SETDB1
SCHEMBL22429826 0.73

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-3778573-A1 COMPOUND WITH ANTICANCER ACTIVITY Kyowa Kirin Co., Ltd. (JP) 2021-02-17 EP disclosed
WO-2019189778-A1 COMPOUND WITH ANTICANCER ACTIVITY 協和発酵キリン株式会社 2019-10-03 WO disclosed