SCHEMBL5170645

SCHEMBL5170645

O=C(O)C=Cc1ccc(Oc2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2F)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.51
KCNQ2 O43526 1/20 0.51
KCNE1 P15382 1/20 0.51
KCNQ1 P51787 1/20 0.51
MAPT P10636 3/20 0.49
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
PKM P14618 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
PNLIP P16233 3/20 0.47
TP53 P04637 2/20 0.47
PARG Q86W56 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
MET P08581 1/20 0.44
BCAT2 O15382 1/20 0.43
SRD5A2 P31213 1/20 0.42

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
SCHEMBL5170635 1.00 KCNQ3 (0.51) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3131474 0.88 KDM4E (0.53) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3138644 0.87 MAPT (0.46) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3142159 0.85 KCNQ3 (0.67) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3138647 0.82 KCNQ3 (0.47) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3138650 0.82 KCNQ3 (0.47) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3137838 0.81 KDM4E (0.53) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL8915769 0.81 KDM4E (0.53) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3146704 0.81 KCNQ3 (0.52) KCNQ3KCNQ2KCNE1KCNQ1MAPT
SCHEMBL3142227 0.81 KDM4E (0.52) KCNQ3KCNQ2KCNE1KCNQ1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120238750-A1 AROMATIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-20 US disclosed
EP-1773797-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-04-18 EP disclosed
WO-2006014012-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-02-09 WO 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-20120238750-A1 AROMATIC COMPOUND CBR1, CBR3, CYP1A1 KCNQ3 1570/4885KCNQ2 1451/4885KCNE1 453/4885

“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.