SCHEMBL23950750

SCHEMBL23950750

Cn1cc(-c2nc(-c3ccc(C(F)(F)F)cc3)cc3c(=O)n(-c4cccc(O)c4)cnc23)cn1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 11/20 0.38
FYN P06241 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR3 P22607 1/20 0.36
EPHB4 P54760 1/20 0.35
TEK Q02763 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
FGFR1 P11362 1/20 0.35
DDR2 Q16832 1/20 0.35
RAD51 Q06609 1/20 0.34
OPRD1 P41143 1/20 0.34
NPBWR1 P48145 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
SCHEMBL30101833 1.00 HSP90AA1 (0.38) HSP90AA1FYNFGFR2FGFR3EPHB4
SCHEMBL23950998 0.89 FYN (0.38) HSP90AA1FYNFGFR2FGFR3ESR1
SCHEMBL23925539 0.85 MAPT (0.44) HSP90AA1ESR1ESR2
SCHEMBL23950576 0.83 EPHB4 (0.41) HSP90AA1FGFR2FGFR3EPHB4TEK
SCHEMBL23950267 0.78 TYK2 (0.39) HSP90AA1FGFR2FGFR3EPHB4TEK
SCHEMBL23951134 0.78 EPHB4 (0.38) HSP90AA1FGFR2FGFR3EPHB4TEK
SCHEMBL23950694 0.77 EPHB4 (0.38) HSP90AA1FGFR2FGFR3EPHB4TEK
SCHEMBL23950919 0.77 PIK3CA (0.39) FGFR2FGFR3EPHB4TEKPIK3CA
SCHEMBL30101847 0.77 PIK3CA (0.39) FGFR2FGFR3EPHB4TEKPIK3CA
SCHEMBL23925513 0.77 TYK2 (0.40) HSP90AA1FGFR2FGFR3EPHB4TEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 HSP90AA1 690/4885FYN 1546/4885FGFR2 152/4885

“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.