SCHEMBL420976

SCHEMBL420976

CC1=NN(c2ccccc2)C(=O)/C1=C/N(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 1.00
KMT2A Q03164 11/20 0.70
MEN1 O00255 7/20 0.70
HSP90AA1 P07900 2/20 0.70
MAPT P10636 12/20 0.67
MAPK1 P28482 8/20 0.67
ALDH1A1 P00352 7/20 0.67
PKM P14618 5/20 0.67
HTT P42858 4/20 0.67
GAA P10253 3/20 0.67
POLB P06746 2/20 0.67
OPRK1 P41145 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
RECQL P46063 1/20 0.67
MMP14 P50281 1/20 0.67
ABCG2 Q9UNQ0 1/20 0.67
TDP1 Q9NUW8 6/20 0.63
L3MBTL1 Q9Y468 6/20 0.59
LMNA P02545 3/20 0.59
NPC1 O15118 1/20 0.59

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
SCHEMBL444648 1.00 KDM4E (1.00) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL9527009 0.85 KDM4E (0.74) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL16491206 0.82 KMT2A (1.00) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL9524422 0.82 KMT2A (0.75) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL9727216 0.82 KMT2A (0.75) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL9525471 0.81 KDM4E (0.68) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL14518012 0.81 KDM4E (0.68) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL6952163 0.81 KDM4E (0.68) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL13678890 0.81 KDM4E (0.68) KDM4EKMT2AMEN1HSP90AA1MAPT
SCHEMBL6952167 0.81 KDM4E (0.68) KDM4EKMT2AMEN1HSP90AA1MAPT

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140335517-A1 DETECTION AND TREATMENT OF SCHIZOPHRENIA RENASCIENCE CO LTD (JP) 2014-11-13 US disclosed
US-20140335517-A1 DETECTION AND TREATMENT OF SCHIZOPHRENIA RENASCIENCE CO LTD (JP) 2014-11-13 US disclosed
US-20140335517-A1 DETECTION AND TREATMENT OF SCHIZOPHRENIA RENASCIENCE CO LTD (JP) 2014-11-13 US disclosed
US-8809329-B2 Detection and treatment of schizophrenia TOKYO METROPOLITAN INSTITUTE OF MEDICAL SCIENCE (JP) 2014-08-19 US disclosed
US-8809329-B2 Detection and treatment of schizophrenia TOKYO METROPOLITAN INSTITUTE OF MEDICAL SCIENCE (JP) 2014-08-19 US disclosed
US-8809329-B2 Detection and treatment of schizophrenia TOKYO METROPOLITAN INSTITUTE OF MEDICAL SCIENCE (JP) 2014-08-19 US disclosed
EP-2662453-A2 Detection and treatment of schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2013-11-13 EP disclosed
US-20120065198-A2 Detection and Treatment of Schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2012-03-15 US disclosed
US-20120065198-A2 Detection and Treatment of Schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2012-03-15 US disclosed
US-20120065198-A2 Detection and Treatment of Schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2012-03-15 US disclosed
US-20110028470-A1 Detection and Treatment of Schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2011-02-03 US disclosed
EP-2189537-A1 DETECTION AND TREATMENT OF SCHIZOPHRENIA TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2010-05-26 EP disclosed
US-7645882-B2 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2010-01-12 US disclosed
US-7645882-B2 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2010-01-12 US disclosed
US-7645882-B2 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2010-01-12 US disclosed
US-20070123577-A1 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2007-05-31 US disclosed
US-20070123577-A1 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2007-05-31 US disclosed
US-20070123577-A1 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2007-05-31 US disclosed
EP-1693369-A1 PROTEIN MODIFIER PRODUCTION INHIBITOR TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2006-08-23 EP disclosed
US-5610305-A Pyrazole-and piperidine-containing compounds and their metal complexes as light stabilizers UV STAB LTD. (IL) 1997-03-11 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 (3 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-20070123577-A1 Inhibitor of protein modification products formation SERPINB6, PROC, PLPBP KDM4E 2177/4885KMT2A 2334/4885MEN1 1277/4885
US-20110028470-A1 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 KDM4E 1357/4885KMT2A 1703/4885MEN1 4818/4885
US-20120065198-A2 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 KDM4E 1357/4885KMT2A 1703/4885MEN1 4818/4885

“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.