SCHEMBL31478809

SCHEMBL31478809

COc1ccc(CN2C(=O)C(F)(F)Oc3cc(F)c(-c4c(F)c(F)c(OC)c(F)c4F)cc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.39
SCN9A Q15858 2/20 0.38
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
CHRM5 P08912 5/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CASP3 P42574 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 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
SCHEMBL25359029 0.98 CMA1 (0.38) CMA1SCN9AGSK3AGSK3BCHRM5
SCHEMBL25359718 0.93 PTPN1 (0.37) CMA1SCN9AGSK3AGSK3BCHRM5
SCHEMBL26001083 0.93 KDM4E (0.37) CMA1SCN9AGSK3AGSK3BCHRM5
SCHEMBL26001081 0.91 SCN9A (0.39) CMA1SCN9AGSK3AGSK3BCHRM5
SCHEMBL25355571 0.90 SCN9A (0.38) CMA1SCN9AGSK3AGSK3BCHRM5
SCHEMBL25358852 0.88 SCN9A (0.37) SCN9AL3MBTL1CASP3MAPTHTT
SCHEMBL30193711 0.88 SCN9A (0.37) SCN9AL3MBTL1CASP3MAPTHTT
SCHEMBL26001112 0.86 CHRM5 (0.39) CMA1SCN9AGSK3AGSK3BCHRM5
SCHEMBL25356447 0.83 ALDH1A1 (0.31) ALDH1A1
SCHEMBL28495237 0.83 CMA1 (0.43) CMA1SCN9AGSK3AGSK3BCHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084044-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS ENKO CHEM, INC. (US) 2025-03-13 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 (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-20250084044-A1 PROTOPORPHYRINOGEN OXIDASE INHIBITORS PPOX, CYP4X1, PNPO CMA1 2763/4885SCN9A 4125/4885GSK3A 1299/4885

“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.