SCHEMBL12834565

SCHEMBL12834565

CC1=C(C(=O)c2ccc(Br)cc2)C(=O)c2ccccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.51
MEN1 O00255 7/20 0.51
MAPT P10636 7/20 0.51
LMNA P02545 6/20 0.51
KDM4E B2RXH2 5/20 0.51
HTT P42858 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
NPSR1 Q6W5P4 4/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
TDP1 Q9NUW8 3/20 0.51
MAPK1 P28482 3/20 0.51
XBP1 P17861 2/20 0.51
HSP90AA1 P07900 2/20 0.51
MPI P34949 1/20 0.51
AURKA O14965 1/20 0.49
AURKB Q96GD4 1/20 0.49
ALDH1A1 P00352 6/20 0.47
L3MBTL1 Q9Y468 5/20 0.47
HKDC1 Q2TB90 2/20 0.47

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
SCHEMBL12761941 0.87 ALDH1A1 (0.51) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL7098579 0.86 ALDH1A1 (0.62) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL12834559 0.85 LMNA (0.49) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL12834560 0.85 KMT2A (0.59) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL12834569 0.84 ALDH1A1 (0.47) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL12834576 0.84 ALDH1A1 (0.58) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL12834572 0.83 STAT3 (0.49) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL12834571 0.81 SRD5A2 (0.47) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL12969793 0.81 MEN1 (0.55) KMT2AMEN1MAPTLMNAKDM4E
SCHEMBL1507053 0.81 CDC25B (0.52) KMT2AMEN1MAPTLMNAHTT

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
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 (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-20110059972-A1 1,4-NAPHTHOQUINONES DERIVATIVES AND THERAPEUTIC USE THEREOF NQO1, NDUFV2, RECQL KMT2A 2271/4885MEN1 2491/4885MAPT 2505/4885

“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.