SCHEMBL8658115

SCHEMBL8658115

N#CCc1cc(I)cc(CC#N)c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ENPP2 Q13822 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MMP3 P08254 1/20 0.34

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
SCHEMBL15956017 0.89 KDM4E (0.37) KDM4ETDP1ENPP2MMP3
SCHEMBL4007007 0.86 KDM4E (0.52) KDM4ETDP1ENPP2MEN1KMT2A
SCHEMBL641274 0.84 KDM4E (0.37) KDM4ETDP1ENPP2MMP3
SCHEMBL28154255 0.80 KDM4E (0.34) KDM4ETDP1MMP3
SCHEMBL15955617 0.80 KDM4E (0.34) KDM4ETDP1
SCHEMBL481477 0.77 ENPP2 (0.53) KDM4ETDP1ENPP2MEN1KMT2A
SCHEMBL8657492 0.74 KDM4E (0.43) KDM4ETDP1ENPP2MEN1KMT2A
SCHEMBL480922 0.74 CYP3A4 (0.41) KDM4ETDP1ENPP2KMT2AMMP3
SCHEMBL8655473 0.74 KDM4E (0.43) KDM4ETDP1ENPP2MEN1KMT2A
SCHEMBL18301559 0.74 KDM4E (0.43) KDM4ETDP1ENPP2MEN1KMT2A

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-20140308317-A1 Polymeric Compounds And Methods Of Making And Using The Same CELLCEUTIX CORPORATION (US) 2014-10-16 US disclosed
US-20140308317-A1 Polymeric Compounds And Methods Of Making And Using The Same CELLCEUTIX CORPORATION (US) 2014-10-16 US disclosed
WO-2014093225-A2 POLYCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME CELLCEUTIX CORPORATION (US) 2014-06-19 WO disclosed
EP-0714893-B1 2-substituted benzothiazole derivatives useful in the treatment of diabetic complications GRELAN PHARMACEUTICAL CO (JP) 1998-10-21 EP disclosed
US-5700819-A ALDOSE REDUCTASE ENZYME INHIBITOR GRELAN PHARMACEUTICAL CO., LTD. (JP) 1997-12-23 US disclosed
EP-0714893-A1 2-substituted benzothiazole derivatives useful in the treatment of diabetic complications GRELAN PHARMACEUTICAL CO., LTD. (JP) 1996-06-05 EP 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-20140308317-A1 Polymeric Compounds And Methods Of Making And Using The Same ALG1, CD44, MUC1 KDM4E 4424/4885TDP1 3844/4885ENPP2 340/4885

“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.