SCHEMBL15948331

SCHEMBL15948331

NC(=O)c1ccc(CNC(=O)OCC2c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
EPHX2 P34913 2/20 0.47
HDAC1 Q13547 2/20 0.44
HDAC6 Q9UBN7 1/20 0.44
PLAU P00749 1/20 0.43
HDAC3 O15379 1/20 0.41
HDAC2 Q92769 1/20 0.41
TPSAB1 Q15661 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
FABP7 O15540 1/20 0.41
FABP5 Q01469 1/20 0.41
KDM1A O60341 1/20 0.41
MAOA P21397 1/20 0.41
OPRD1 P41143 1/20 0.41

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
SCHEMBL5811433 0.90 KMT2A (0.51) KMT2AEPHX2PLAUTPSAB1FABP7
SCHEMBL29678978 0.89 KMT2A (0.56) KMT2AEPHX2NR1H4FABP7FABP5
SCHEMBL29402075 0.89 KMT2A (0.56) KMT2AEPHX2NR1H4FABP7FABP5
SCHEMBL118108 0.89 KMT2A (0.56) KMT2AEPHX2NR1H4FABP7FABP5
SCHEMBL16256817 0.88 KMT2A (0.52) KMT2AEPHX2NR1H4FABP7FABP5
SCHEMBL31010055 0.87 KMT2A (0.55) KMT2AEPHX2PLAUFABP7FABP5
SCHEMBL14485271 0.87 KMT2A (0.59) KMT2AEPHX2TPSAB1FABP7FABP5
SCHEMBL2057615 0.87 KMT2A (0.55) KMT2AEPHX2PLAUFABP7FABP5
SCHEMBL3177417 0.87 KMT2A (0.62) KMT2AEPHX2FABP7FABP5OPRD1
Hydrochloric Acid SCHEMBL14485267 0.86 KMT2A (0.57) KMT2AEPHX2TPSAB1FABP7FABP5

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
US-9464064-B2 HCV helicase inhibitors and methods of use thereof UNIVERSITY OF KANSAS (US) 2016-10-11 US disclosed
US-20140227225-A1 HCV Helicase Inhibitors and Methods of Use Thereof UWM RESEARCH FOUNDATION, INC. (US) 2014-08-14 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-20140227225-A1 HCV Helicase Inhibitors and Methods of Use Thereof DHX15, DDX5, DHX35 KMT2A 3831/4885EPHX2 524/4885HDAC1 1870/4885

“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.