SCHEMBL8713331

SCHEMBL8713331

CSc1oc2ccc(Br)cc2c(=O)c1C=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.49
ALPG P10696 1/20 0.47
MAPK1 P28482 2/20 0.44
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.43
CA12 O43570 2/20 0.43
CA9 Q16790 2/20 0.43
PIM1 P11309 1/20 0.42
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP2A6 P11509 1/20 0.40
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
GABRP O00591 3/20 0.38
GABRD O14764 3/20 0.38
GABRA1 P14867 3/20 0.38
GABRB1 P18505 3/20 0.38
GABRG2 P18507 3/20 0.38

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
SCHEMBL29951128 0.79 KMT2A (0.68) PTPN1ALPGMAPK1KMT2ALMNA
SCHEMBL7809159 0.78 KMT2A (0.42) PTPN1MAPK1KMT2ALMNACA12
SCHEMBL7800035 0.74 CA1 (0.51) KMT2ALMNACA12CA9PIM1
SCHEMBL29416622 0.73 PIM1 (0.58) PTPN1KMT2ALMNACA12CA9
SCHEMBL2588529 0.73 PIM1 (0.58) PTPN1KMT2ALMNACA12CA9
SCHEMBL177487 0.71 PTPN1 (0.44) PTPN1ALPGMAPK1KMT2ALMNA
SCHEMBL16974052 0.70 CYP2A6 (0.45) PTPN1ALPGKMT2ALMNAMEN1
SCHEMBL29953189 0.70 CA12 (0.62) PTPN1CA12CA9PIM1KDM4E
SCHEMBL30940281 0.70 ALPG (0.68) ALPGMAPK1KMT2ALMNAMEN1
SCHEMBL29955895 0.70 CA9 (0.48) PTPN1CA12CA9PIM1CYP2A6

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-1998027080-A1 CHROMONES USEFUL AS FUNGICIDES AGREVO UK LIMITED (GB) 1998-06-25 WO disclosed