SCHEMBL28272012

SCHEMBL28272012

Cn1nc(C(N)=O)c(O)c1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
GRM5 P41594 2/20 0.44
KDM4E B2RXH2 3/20 0.43
ADORA2A P29274 2/20 0.43
LMNA P02545 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
PKM P14618 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
KAT2B Q92831 1/20 0.43
CCNA2 P20248 5/20 0.42
CDK2 P24941 5/20 0.42
CCNA1 P78396 3/20 0.42
PLK1 P53350 2/20 0.42
CSF1R P07333 1/20 0.41
FGFR1 P11362 1/20 0.41
FLT1 P17948 1/20 0.41
KDR P35968 1/20 0.41

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
SCHEMBL280162 0.85 CSF1R (0.46) POLBCA1CA2GRM5KDM4E
SCHEMBL30900619 0.80 GRM5 (0.58) POLBCA1CA2GRM5KDM4E
SCHEMBL28271968 0.78 CNR1 (0.54) KMT2AMEN1
SCHEMBL11674731 0.75 MEN1 (0.50) POLBCA1CA2KDM4ELMNA
SCHEMBL14154662 0.75 ALDH1A1 (0.52) POLBCA1CA2KDM4EADORA2A
SCHEMBL21408239 0.74 POLB (0.56) POLBCA1CA2KDM4ELMNA
SCHEMBL7755885 0.74 MAPT (0.49) POLBCA1CA2GRM5KDM4E
SCHEMBL30988460 0.73 GRM5 (0.59) CA1CA2GRM5
SCHEMBL27850030 0.72 MAP2K1 (0.48) POLBKDM4ECLK4DYRK1BKMT2A
SCHEMBL1483542 0.72 KDM5A (0.46) LMNAKMT2AMEN1ALDH1A1MAPT

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
CN-109232426-A A kind of N- hydroxyl -5- substitution -1H- pyrazole-3-formamide compound and its preparation method and application 中国药科大学 2019-01-18 CN disclosed