SCHEMBL6923784

SCHEMBL6923784

O=C(O)c1cccc(/C=N/O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UNG P13051 2/20 0.63
KMT2A Q03164 2/20 0.60
TTR P02766 3/20 0.54
MAPT P10636 2/20 0.53
NSD2 O96028 1/20 0.53
POLB P06746 1/20 0.53
NR4A1 P22736 1/20 0.53
APEX1 P27695 1/20 0.53
MAPK1 P28482 1/20 0.53
PTPN7 P35236 1/20 0.53
RECQL P46063 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
FBP1 P09467 1/20 0.51
P4HB P07237 1/20 0.49
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA12 O43570 1/20 0.48

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
SCHEMBL2165506 1.00 UNG (0.63) UNGKMT2ATTRMAPTNSD2
SCHEMBL935785 1.00 UNG (0.63) UNGKMT2ATTRMAPTNSD2
SCHEMBL8230316 0.83 PARP1 (0.50) UNGKMT2AMAPTPOLBMAPK1
SCHEMBL4106983 0.83 UNG (0.61) UNGTTRFBP1P4HBCA1
SCHEMBL12581543 0.80 UNG (0.58) UNGKMT2ATTRMAPTPOLB
SCHEMBL8899992 0.79 TTR (0.79) UNGTTRHSD17B10FBP1P4HB
SCHEMBL808972 0.79 TTR (0.79) UNGTTRHSD17B10FBP1P4HB
SCHEMBL9075299 0.79 TTR (0.79) UNGTTRHSD17B10FBP1P4HB
SCHEMBL31490527 0.79 KMT2A (0.63) UNGKMT2ATTRMAPTNSD2
SCHEMBL27604259 0.79 UNG (0.73) UNGTTRHSD17B10TDP1FBP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023077070-A1 RXFP1 AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-05-04 WO disclosed
CN-114380762-A Isoxazoline hydrazide derivative and preparation method and application thereof 贵州大学 2022-04-22 CN disclosed
WO-2011009484-A1 ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS NOVARTIS AG (CH) 2011-01-27 WO disclosed