SCHEMBL12833652

SCHEMBL12833652

CC1=C(Cc2c(F)c(F)c(F)c(F)c2F)C(=O)c2ccccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 3/20 0.51
HTT P42858 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
APAF1 O14727 1/20 0.51
MITF O75030 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TBXAS1 P24557 1/20 0.51
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
PTGS1 P23219 2/20 0.43
PDE4A P27815 2/20 0.43
SNCA P37840 2/20 0.43
PDE3A Q14432 2/20 0.43
PGR P06401 1/20 0.43
HTR1A P08908 1/20 0.43

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
SCHEMBL5810540 0.83 TBXAS1 (0.62) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL29906397 0.78 MAPT (0.52) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL26982477 0.78 MAPT (0.52) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL12833647 0.78 ALDH1A1 (0.62) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL7912380 0.77 TBXAS1 (0.69) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL5820368 0.75 MAPT (0.58) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL26982487 0.74 TBXAS1 (0.57) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL29906459 0.74 TBXAS1 (0.57) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL12761935 0.74 TBXAS1 (0.60) MAPTKDM4EALDH1A1LMNAHTT
SCHEMBL29906350 0.74 TBXAS1 (0.53) MAPTKDM4EALDH1A1LMNAHTT

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
US-20240174589-A1 PHOTOREDOX RADICAL BENZYLATION PROCESS CENTRE NAT RECH SCIENT (FR) 2024-05-30 US disclosed
EP-4301722-A1 PHOTOREDOX RADICAL BENZYLATION PROCESS Centre National de la Recherche Scientifique (FR) 2024-01-10 EP disclosed
WO-2022184904-A1 PHOTOREDOX RADICAL BENZYLATION PROCESS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2022-09-09 WO disclosed
EP-4053096-A1 PHOTOREDOX RADICAL BENZYLATION PROCESS Centre national de la recherche scientifique (FR) 2022-09-07 EP disclosed
EP-2257515-B1 1,4-NAPHTHOQUINONE DERIVATIVES AND THERAPEUTIC USE THEREOF CENTRE NAT RECH SCIENT (FR) 2017-05-17 EP disclosed
US-20110059972-A1 1,4-NAPHTHOQUINONES DERIVATIVES AND THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2011-03-10 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-20110059972-A1 1,4-NAPHTHOQUINONES DERIVATIVES AND THERAPEUTIC USE THEREOF NQO1, NDUFV2, RECQL MAPT 2505/4885KDM4E 2871/4885ALDH1A1 539/4885
US-20240174589-A1 PHOTOREDOX RADICAL BENZYLATION PROCESS H1-2, H1-3, H1-0 MAPT 3960/4885KDM4E 1648/4885ALDH1A1 860/4885

“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.