SCHEMBL16291963

SCHEMBL16291963

FC(F)(F)n1ncc2cccnc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
KDM4D Q6B0I6 1/20 0.41
FGFR1 P11362 1/20 0.35
FGFR4 P22455 1/20 0.35
CYP3A4 P08684 3/20 0.34
CYP2D6 P10635 3/20 0.34
GMNN O75496 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
HSP90AA1 P07900 1/20 0.34
MMP2 P08253 1/20 0.34
MAPT P10636 1/20 0.34
MMP9 P14780 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
MMP8 P22894 1/20 0.34
CCR1 P32246 1/20 0.34
THPO P40225 1/20 0.34
MTOR P42345 1/20 0.34

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
SCHEMBL12775617 0.81 KDM4E (0.50) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL30668855 0.77 KDM4E (0.54) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL30182171 0.74 KDM4E (0.46) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL31507011 0.73 IRAK4 (0.33)
SCHEMBL29570632 0.71 KDM4E (0.40) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL23227964 0.71 KDM4E (0.55) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL7008753 0.71 KDM4E (0.55) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL3375873 0.71 KDM4E (0.55) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL14895754 0.71 KDM4E (0.55) KDM4EKDM4DFGFR1FGFR4CYP3A4
SCHEMBL21089903 0.71 KDM4E (0.59) KDM4EKDM4DFGFR1FGFR4CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024074977-A1 SUBSTITUTED 1 H-PYRAZOLO-PYRIDINE AND-PYRIMIDINE COMPOUNDS PFIZER INC. (US) 2024-04-11 WO disclosed
US-10633369-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2020-04-28 US disclosed
EP-3619209-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS Glenmark Pharmaceuticals S.A. (CH) 2020-03-11 EP disclosed
WO-2018203298-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2018-11-08 WO disclosed
US-20180201606-A1 METHOD OF INHIBITING DYRK1B 4 SC AG (DE) 2018-07-19 US disclosed
US-9951050-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2018-04-24 US disclosed
US-20140371251-A1 METHOD OF INHIBITING DYRK1B 4SC DISCOVERY GMBH (DE) 2014-12-18 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 (3 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-10633369-B2 Method of inhibiting DYRK1B SMO, GLI1, GRK2 KDM4E 996/4885KDM4D 1862/4885FGFR1 834/4885
US-20180201606-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 KDM4E 996/4885KDM4D 1862/4885FGFR1 834/4885
US-20140371251-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 KDM4E 996/4885KDM4D 1862/4885FGFR1 834/4885

“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.