SCHEMBL23950694

SCHEMBL23950694

Cn1cc(-c2nc(-c3ccc(C(F)(F)F)cc3)cc3c(=O)n(CC(O)C(F)(F)F)cnc23)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 1/20 0.38
TEK Q02763 1/20 0.38
IRAK1 P51617 2/20 0.37
NPBWR1 P48145 1/20 0.36
FGFR2 P21802 4/20 0.34
FGFR3 P22607 4/20 0.34
FGFR1 P11362 3/20 0.34
FGFR4 P22455 3/20 0.34
KDR P35968 3/20 0.34
TYK2 P29597 3/20 0.34
JAK2 O60674 2/20 0.34
JAK1 P23458 2/20 0.34
JAK3 P52333 2/20 0.34
HSP90AA1 P07900 3/20 0.34
DDR1 Q08345 2/20 0.33
FLT3 P36888 1/20 0.33
SYK P43405 1/20 0.33
AURKB Q96GD4 1/20 0.33
CSF1R P07333 1/20 0.33
WNT1 P04628 1/20 0.33

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
SCHEMBL23951134 0.92 EPHB4 (0.38) EPHB4TEKNPBWR1FGFR2FGFR3
SCHEMBL29610270 0.92 IRAK1 (0.36) IRAK1NPBWR1FGFR2FGFR3FGFR1
SCHEMBL29610268 0.92 IRAK1 (0.36) IRAK1NPBWR1FGFR2FGFR3FGFR1
SCHEMBL23390258 0.92 IRAK1 (0.36) IRAK1NPBWR1FGFR2FGFR3FGFR1
SCHEMBL23390217 0.92 IRAK1 (0.36) IRAK1NPBWR1FGFR2FGFR3FGFR1
SCHEMBL23390219 0.92 IRAK1 (0.36) IRAK1NPBWR1FGFR2FGFR3FGFR1
SCHEMBL23390474 0.92 IRAK1 (0.37) IRAK1FGFR2FGFR3FGFR1FGFR4
SCHEMBL23390186 0.91 GRM2 (0.38) IRAK1FGFR2FGFR3FGFR1FGFR4
SCHEMBL23390510 0.91 GRM2 (0.38) IRAK1FGFR2FGFR3FGFR1FGFR4
SCHEMBL23390188 0.91 GRM2 (0.38) IRAK1FGFR2FGFR3FGFR1FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4136088-A1 PYRIDOPYRIMIDINONE DERIVATIVES AND THEIR USE AS ARYL HYDROCARBON RECEPTOR MODULATORS Dong-A ST Co., Ltd. (KR) 2023-02-22 EP claimed
US-20230147257-A1 PYRIDOPYRIMIDINONE DERIVATIVES AND THEIR USE AS ARYL HYDROCARBON RECEPTOR MODULATORS DONG-A ST CO., LTD. (KR) 2023-05-11 US disclosed
US-20230147257-A1 PYRIDOPYRIMIDINONE DERIVATIVES AND THEIR USE AS ARYL HYDROCARBON RECEPTOR MODULATORS DONG-A ST CO., LTD. (KR) 2023-05-11 US disclosed
EP-4136088-A1 PYRIDOPYRIMIDINONE DERIVATIVES AND THEIR USE AS ARYL HYDROCARBON RECEPTOR MODULATORS Dong-A ST Co., Ltd. (KR) 2023-02-22 EP disclosed
CN-115443276-A Pyridopyrimidinone derivatives and their use as modulators of aromatic hydrocarbon receptors 东亚ST株式会社 2022-12-06 CN disclosed
WO-2021210970-A1 PYRIDOPYRIMIDINONE DERIVATIVES AND THEIR USE AS ARYL HYDROCARBON RECEPTOR MODULATORS DONG-A ST CO., LTD. (KR) 2021-10-21 WO 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-20230147257-A1 PYRIDOPYRIMIDINONE DERIVATIVES AND THEIR USE AS ARYL HYDROCARBON RECEPTOR MODULATORS AHR, ARNT, AIPL1 EPHB4 1197/4885TEK 264/4885IRAK1 197/4885

“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.