SCHEMBL26316561

SCHEMBL26316561

Fc1cc(Br)ccc1/C=C/c1nc(COc2ccc(CCCCn3ccnn3)cc2)co1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 1/20 0.66
MINK1 Q8N4C8 1/20 0.66
FGFR1 P11362 2/20 0.35
FLT1 P17948 2/20 0.35
FGFR2 P21802 2/20 0.35
FGFR4 P22455 2/20 0.35
FGFR3 P22607 2/20 0.35
FLT4 P35916 2/20 0.35
KDR P35968 2/20 0.35
EGFR P00533 1/20 0.35
PDGFRB P09619 1/20 0.35
MAPT P10636 2/20 0.32
FFAR1 O14842 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
ATP4A P20648 1/20 0.31
ATP4B P51164 1/20 0.31
NCF1 P14598 2/20 0.30

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
SCHEMBL31130669 1.00 ERBB2 (0.66) ERBB2MINK1FGFR1FLT1FGFR2
SCHEMBL22398061 1.00 ERBB2 (0.66) ERBB2MINK1FGFR1FLT1FGFR2
SCHEMBL6582279 0.92 ERBB2 (0.68) ERBB2MINK1MAPTFFAR1ATP4A
SCHEMBL6582276 0.92 ERBB2 (0.68) ERBB2MINK1MAPTFFAR1ATP4A
SCHEMBL5385109 0.91 ERBB2 (0.66) ERBB2MINK1FGFR1FLT1FGFR2
SCHEMBL22398264 0.91 ERBB2 (0.66) ERBB2MINK1MAPTFFAR1ATP4A
SCHEMBL28900623 0.91 ERBB2 (0.66) ERBB2MINK1FGFR1FLT1FGFR2
SCHEMBL22397958 0.91 ERBB2 (0.66) ERBB2MINK1FGFR1FLT1FGFR2
SCHEMBL5385106 0.91 ERBB2 (0.66) ERBB2MINK1FGFR1FLT1FGFR2
SCHEMBL28481371 0.91 ERBB2 (0.66) ERBB2MINK1MAPTFFAR1ATP4A

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
CN-111886234-B Heterocyclic mitochondrial activity inhibitors and uses thereof 蒙特利尔大学 2023-12-15 CN disclosed
US-20230357221-A1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF UNIV MONTREAL (CA) 2023-11-09 US disclosed
US-20230357221-A1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF UNIV MONTREAL (CA) 2023-11-09 US disclosed
US-11760754-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof Université de Montréal (CA) 2023-09-19 US disclosed
US-11760754-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof Université de Montréal (CA) 2023-09-19 US disclosed
CN-111886234-A Heterocyclic mitochondrial activity inhibitors and uses thereof 蒙特利尔大学 2020-11-03 CN 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-20230357221-A1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF IDH2, TFAM, IDH1 ERBB2 2558/4885MINK1 1781/4885FGFR1 1105/4885
US-11760754-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof IDH2, TFAM, NUTF2 ERBB2 2443/4885MINK1 1986/4885FGFR1 1032/4885

“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.