SCHEMBL25329372

SCHEMBL25329372

CCOC(=O)C1(c2cccc(C(F)(F)F)c2)CC(=O)c2ccccc2N1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
MAPT P10636 1/20 0.38
BRD4 O60885 1/20 0.36
GAA P10253 3/20 0.36
KDM4E B2RXH2 2/20 0.36
OPRM1 P35372 3/20 0.36
GPR119 Q8TDV5 1/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
GALR3 O60755 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
TP53 P04637 1/20 0.36
CACNA1F O60840 1/20 0.36
CACNA1D Q01668 1/20 0.36
CACNA1S Q13698 1/20 0.36
CACNA1C Q13936 1/20 0.36
ALOX15 P16050 1/20 0.36
THRB P10828 1/20 0.35
OPRL1 P41146 1/20 0.35

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
SCHEMBL25327896 0.85 OPRM1 (0.46) ALDH1A1MAPTBRD4GAAKDM4E
SCHEMBL27313017 0.71 BRD4 (0.45) ALDH1A1MAPTBRD4GAAKDM4E
SCHEMBL14893687 0.70 OPRM1 (0.51) OPRM1OPRD1OPRK1
SCHEMBL27870437 0.70 BRD4 (0.55) ALDH1A1MAPTBRD4GAAOPRM1
Hydrochloric Acid SCHEMBL11114651 0.69 OPRM1 (0.65) OPRM1OPRD1OPRK1
SCHEMBL7961399 0.68 ALDH1A1 (0.41) ALDH1A1GAACACNA1FCACNA1DCACNA1S
SCHEMBL11141405 0.66 HCAR3 (0.41) ALDH1A1MAPTGAAKDM4ETP53
SCHEMBL22915221 0.66 ALDH1A1 (0.46) ALDH1A1MAPTBRD4GAAKDM4E
SCHEMBL11140391 0.65 THRB (0.38) ALDH1A1MAPTGAAKDM4ECACNA1F
SCHEMBL2373128 0.65 HCAR3 (0.34) ALDH1A1OPRM1GALR3CACNA1FCACNA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12109207-B2 Methods of using 4(1H)-quinolone derivatives ACADEMIA SINICA (TW) 2024-10-08 US disclosed
US-20230233549-A1 METHODS OF USING 4(1H)-QUINOLONE DERIVATIVES ACADEMIA SINICA (TW) 2023-07-27 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 (2 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-12109207-B2 Methods of using 4(1H)-quinolone derivatives TUBB1, TUBB3, TUBB ALDH1A1 1707/4885MAPT 144/4885BRD4 751/4885
US-20230233549-A1 METHODS OF USING 4(1H)-QUINOLONE DERIVATIVES TUBB1, TUBB3, TUBB ALDH1A1 1707/4885MAPT 144/4885BRD4 751/4885

“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.