SCHEMBL7108974

SCHEMBL7108974

COc1c(N2CCNC3(CC3)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3F)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.58
HPGD P15428 4/20 0.58
ALDH1A1 P00352 4/20 0.58
KCNH2 Q12809 3/20 0.58
HSD17B10 Q99714 2/20 0.58
POLB P06746 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
PRKD3 O94806 1/20 0.58
ALOX15 P16050 1/20 0.58
OPRM1 P35372 1/20 0.58
CLK2 P49760 1/20 0.58
CLK4 Q9HAZ1 1/20 0.58
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
CYP3A4 P08684 1/20 0.49
LMNA P02545 3/20 0.48
CYP2C19 P33261 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ATM Q13315 1/20 0.44
TOP1 P11387 3/20 0.44

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
SCHEMBL4713049 1.00 KDM4E (0.58) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL9080367 0.90 KDM4E (0.72) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL9078074 0.84 KDM4E (0.52) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL9078747 0.84 KDM4E (0.56) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL9079476 0.83 KDM4E (0.55) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL4713727 0.83 KDM4E (0.58) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL4713729 0.83 KDM4E (0.58) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL4716755 0.82 KDM4E (0.65) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL4713767 0.82 KDM4E (0.67) KDM4EHPGDALDH1A1KCNH2HSD17B10
SCHEMBL2670395 0.82 CYP3A4 (0.57) KDM4EHPGDALDH1A1KCNH2HSD17B10

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
US-20030119848-A1 Anti acid-fast bacterial agent containing pyridonecarboxylic acids as active ingredient DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-06-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030119848-A1 Anti acid-fast bacterial agent containing pyridonecarboxylic acids as active ingredient PGD, PPA1, FASTKD1 KDM4E 3677/4885HPGD 146/4885ALDH1A1 800/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.