SCHEMBL19728795

SCHEMBL19728795

CCOC(=O)c1cn(-c2cc(N)c(F)cc2COC(C)=O)c2cc(N(C)CC)c(F)cc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
PIM1 P11309 1/20 0.38
IRAK1 P51617 1/20 0.38
CAMK2B Q13554 1/20 0.38
CAMK2G Q13555 1/20 0.38
CAMK2D Q13557 1/20 0.38
PIM3 Q86V86 1/20 0.38
STAT3 P40763 2/20 0.38
ROCK2 O75116 1/20 0.37
CDK1 P06493 1/20 0.37
PRKACA P17612 1/20 0.37
CDK2 P24941 1/20 0.37
CSNK1D P48730 1/20 0.37
GSK3A P49840 1/20 0.37
CDK5 Q00535 1/20 0.37
PRKCD Q05655 1/20 0.37

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
SCHEMBL19728640 0.90 KMT2A (0.50) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19728792 0.82 KDM4E (0.47) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19728789 0.82 KDM4E (0.47) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19728798 0.82 STAT3 (0.55) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19728365 0.82 KDM4E (0.50) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL20912578 0.80 STAT3 (0.49) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19728785 0.80 KDM4E (0.45) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19729402 0.80 LMNA (0.38) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19728641 0.80 ALDH1A1 (0.44) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL19729059 0.79 STAT3 (0.47) KMT2AALDH1A1KDM4EHPGDHSD17B10

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-2017217441-A1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF 湧永製薬株式会社 2017-12-21 WO disclosed