SCHEMBL8915769

SCHEMBL8915769

O=C(Nc1ccc(Oc2ccc(CO)cc2)c(F)c1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
MAPT P10636 1/20 0.53
PKM P14618 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
KCNQ3 O43525 1/20 0.52
KCNQ2 O43526 1/20 0.52
KCNE1 P15382 1/20 0.52
KCNQ1 P51787 1/20 0.52
PNLIP P16233 4/20 0.47
MET P08581 1/20 0.47
PARG Q86W56 1/20 0.46
BCAT2 O15382 1/20 0.46

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
SCHEMBL3137838 0.91 KDM4E (0.53) KDM4EMEN1NPC1MAPTPKM
SCHEMBL8915931 0.90 KDM4E (0.52) KDM4EMEN1NPC1MAPTPKM
SCHEMBL3140021 0.90 KDM4E (0.49) KDM4EMEN1NPC1MAPTPKM
SCHEMBL3133310 0.87 KDM4E (0.48) KDM4EMEN1NPC1MAPTPKM
SCHEMBL3142159 0.86 KCNQ3 (0.67) KDM4EMEN1NPC1MAPTPKM
SCHEMBL3142227 0.86 KDM4E (0.52) KDM4EMEN1NPC1MAPTPKM
SCHEMBL13742001 0.85 KDM4E (0.67) KDM4EMEN1NPC1MAPTPKM
SCHEMBL3131474 0.85 KDM4E (0.53) KDM4EMEN1NPC1MAPTPKM
SCHEMBL3146704 0.84 KCNQ3 (0.52) KDM4EMEN1NPC1MAPTPKM
SCHEMBL11959943 0.83 NPC1 (0.59) KDM4EMEN1NPC1MAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 US disclosed
US-8188277-B2 Aromatic compounds for suppressing the generation of collagen OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 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-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS ROS1, CBR1, CBR3 KDM4E 2010/4885MEN1 1851/4885NPC1 1397/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 KDM4E 988/4885MEN1 3512/4885NPC1 2588/4885

“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.