SCHEMBL1665273

SCHEMBL1665273

N#Cc1cnn(C2CCCC2)c1N

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.55
ALOX15 P16050 1/20 0.41
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
ABL1 P00519 1/20 0.41
KDR P35968 1/20 0.41
LPAR1 Q92633 5/20 0.40
XDH P47989 1/20 0.37
MAP3K12 Q12852 2/20 0.37
ALDH1A1 P00352 3/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 1/20 0.35
CHEK1 O14757 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CCNA1 P78396 1/20 0.35
CTSK P43235 1/20 0.35

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
SCHEMBL2076461 0.98 PKM (0.57) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL1718493 0.97 PKM (0.51) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL19434452 0.93 PKM (0.50) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL6342254 0.85 PKM (0.44) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL1718320 0.85 PIK3CD (0.45) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL1717485 0.85 PKM (0.44) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL7883515 0.85 PKM (0.48) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL6341184 0.85 PKM (0.45) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL7880394 0.84 ALOX15 (0.63) PKMALOX15KDM4EKMT2AMEN1
SCHEMBL7880389 0.84 CDK2 (0.48) PKMKDM4EKMT2AMEN1ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114621146-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-06-14 CN disclosed
US-9969744-B2 Compounds for use in cognition improvement FUNDACIÓN LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2018-05-15 US disclosed
US-20170217973-A1 NOVEL COMPOUNDS FOR USE IN COGNITION IMPROVEMENT FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2017-08-03 US disclosed
EP-3177622-A1 NOVEL COMPOUNDS FOR USE IN COGNITION IMPROVEMENT Fundacion para la Investigacion Medica Aplicada (ES) 2017-06-14 EP disclosed
EP-2961741-B1 NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES FUND PARA LA INVESTIG MEDICA APLICADA (ES) 2017-04-05 EP disclosed
US-9573956-B2 Compounds as dual inhibitors of phosphodiesterases and histone deacetylases FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2017-02-21 US disclosed
WO-2016020307-A1 NOVEL COMPOUNDS FOR USE IN COGNITION IMPROVEMENT FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2016-02-11 WO disclosed
US-20160002246-A1 NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2016-01-07 US disclosed
EP-2961741-A1 NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES Fundacion para la Investigacion Medica Aplicada (ES) 2016-01-06 EP disclosed
US-9067945-B2 Selective phosphodiesterase 9A inhibitors as medicaments for improving cognitive processes Boehringer Ingehleim International GmbH (DE) 2015-06-30 US disclosed
EP-1534713-A1 ALKYL-SUBSTITUTED PYRAZOLOPYRIMIDINES Bayer HealthCare AG (DE) 2005-06-01 EP disclosed
EP-1534711-A1 PHENYL-SUBSTITUTED PYRAZOLOPYRIMIDINES Bayer HealthCare AG (DE) 2005-06-01 EP disclosed
WO-2004096811-A1 PDE9 INHIBITORS FOR TREATING TYPE 2 DIABETES, METABOKIC SYNDROME, AND CARDIOVASCULAR DISEASE PFIZER PRODUCTS INC. (US) 2004-11-11 WO disclosed
US-20040220186-A1 PDE9 inhibitors for treating type 2 diabetes,metabolic syndrome, and cardiovascular disease PFIZER INC. 2004-11-04 US disclosed
WO-2004026286-A2 SELECTIVE PHOSPHODIESTERASE 9A INHIBITORS AS MEDICAMENTS FOR IMPROVING COGNITIVE PROCESSES BAYER HEALTHCARE AG (DE) 2004-04-01 WO disclosed
WO-2004026286-A2 SELECTIVE PHOSPHODIESTERASE 9A INHIBITORS AS MEDICAMENTS FOR IMPROVING COGNITIVE PROCESSES BAYER HEALTHCARE AG (DE) 2004-04-01 WO disclosed
WO-2004026876-A1 ALKYL-SUBSTITUTED PYRAZOLOPYRIMIDINES BAYER HEALTHCARE AG (DE) 2004-04-01 WO disclosed
WO-2004026876-A1 ALKYL-SUBSTITUTED PYRAZOLOPYRIMIDINES BAYER HEALTHCARE AG (DE) 2004-04-01 WO disclosed
WO-2004018474-A1 PHENYL-SUBSTITUTED PYRAZOLOPYRIMIDINES BAYER HEALTHCARE AG (DE) 2004-03-04 WO disclosed
WO-2004018474-A1 PHENYL-SUBSTITUTED PYRAZOLOPYRIMIDINES BAYER HEALTHCARE AG (DE) 2004-03-04 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 (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-20170217973-A1 NOVEL COMPOUNDS FOR USE IN COGNITION IMPROVEMENT CHAT, NLN, GRIN2C PKM 1516/4885ALOX15 922/4885KDM4E 2381/4885
US-20040220186-A1 PDE9 inhibitors for treating type 2 diabetes,metabolic syndrome, and cardiovascular disease PDE9A, PDE2A, PDE12 PKM 155/4885ALOX15 3258/4885KDM4E 1745/4885
US-20160002246-A1 NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES PDE1A, HDAC1, HDAC2 PKM 840/4885ALOX15 1610/4885KDM4E 530/4885

“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.