SCHEMBL3173446

SCHEMBL3173446

CN1CCN(c2ccnc(N)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.60
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
GLA P06280 1/20 0.60
HRH4 Q9H3N8 9/20 0.59
ADRA2C P18825 2/20 0.56
KDM4E B2RXH2 3/20 0.53
MAPT P10636 2/20 0.53
PTK2B Q14289 2/20 0.53
MAPK1 P28482 1/20 0.53
HTT P42858 1/20 0.53
RECQL P46063 1/20 0.53
ALDH1A1 P00352 1/20 0.52
GFER P55789 1/20 0.52
ESR2 Q92731 1/20 0.52
HRH3 Q9Y5N1 1/20 0.51
ROCK2 O75116 1/20 0.48
ROCK1 Q13464 1/20 0.48
NPC1 O15118 1/20 0.46
RAB9A P51151 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
SCHEMBL16212228 0.83 HRH4 (0.47) GAAKMT2AMEN1GLAHRH4
SCHEMBL1097561 0.83 CHKA (0.52) GAAKMT2AMEN1HRH4KDM4E
SCHEMBL16965450 0.82 JAK2 (0.56) GAAKMT2AMEN1GLAADRA2C
SCHEMBL5847761 0.81 HRH4 (0.54) GAAKMT2AMEN1HRH4KDM4E
SCHEMBL6262576 0.81 HRH4 (0.54) GAAKMT2AMEN1HRH4KDM4E
SCHEMBL2594167 0.81 RAD52 (0.56) GAAKMT2AMEN1GLAHRH4
SCHEMBL13027974 0.80 HRH4 (0.61) GAAKMT2AMEN1GLAHRH4
SCHEMBL21856960 0.79 LNPEP (0.45) GAAKMT2AMEN1GLAHRH4
SCHEMBL9877120 0.79 ALDH1A1 (0.44) GAAKMT2AMEN1HRH4KDM4E
SCHEMBL10767289 0.79 HRH4 (0.39) GAAKMT2AMEN1GLAHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954251-B2 Thienopyrimidine inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-03-23 US disclosed
EP-3048106-B1 THIENOPYRIMIDINE AS INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECH LTD (GB) 2019-11-06 EP disclosed
US-20190106433-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C WINDTREE THERAPEUTICS, INC. 2019-04-11 US disclosed
US-10183950-B2 Thienopyrimidine inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-01-22 US disclosed
US-9938261-B2 Heterocyclic compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2018-04-10 US disclosed
US-20170298022-A1 Diamino-Pyridine, Pyrimidine, and Pyridazine Modulators of the Histamine H4 Receptor JANSSEN PHARMACEUTICA NV (BE) 2017-10-19 US disclosed
US-20170158706-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2017-06-08 US disclosed
US-20170158706-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2017-06-08 US disclosed
EP-2766359-B9 HETEROCYCLIC COMPOUNDS AND USE THEREOF AS MODULATORS OF TYPE III RECEPTOR TYROSINE KINASES AMBIT BIOSCIENCES CORP (US) 2017-04-05 EP disclosed
US-9604994-B2 Thienopyrimidine inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2017-03-28 US disclosed
WO-2013078126-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2013-05-30 WO disclosed
WO-2013056070-A2 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-04-18 WO disclosed
US-20130096113-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-04-18 US disclosed
WO-2013034238-A1 BENZONITRILE DERIVATIVES AS KINASE INHIBITORS MERCK PATENT GMBH (DE) 2013-03-14 WO disclosed
US-20100009987-A1 AMINOTHIAZOLE DERIVATIVES AS INHIBITORS OF MARK MERCK SHARP & DOHME LIMITED (GB) 2010-01-14 US disclosed
US-20100009987-A1 AMINOTHIAZOLE DERIVATIVES AS INHIBITORS OF MARK MERCK SHARP & DOHME LIMITED (GB) 2010-01-14 US disclosed
US-20100009987-A1 AMINOTHIAZOLE DERIVATIVES AS INHIBITORS OF MARK MERCK SHARP & DOHME LIMITED (GB) 2010-01-14 US disclosed
EP-2032138-A2 AMINOTHIAZOLE DERIVATIVES AS INHIBITORS OF MARK Merck Sharp & Dohme Limited (GB) 2009-03-11 EP disclosed
WO-2007141571-A2 AMINOTHIAZOLE DERIVATIVES AS INHIBITORS OF MARK MERCK SHARP & DOHME LIMITED (GB) 2007-12-13 WO disclosed
WO-2007141571-A2 AMINOTHIAZOLE DERIVATIVES AS INHIBITORS OF MARK MERCK SHARP & DOHME LIMITED (GB) 2007-12-13 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 (7 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-20130096113-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF FLT3, PDGFRB, PDGFRA GAA 780/4885KMT2A 1053/4885MEN1 1498/4885
US-10183950-B2 Thienopyrimidine inhibitors of atypical protein kinase C PRKCQ, PRKDC, PRKACA GAA 3362/4885KMT2A 1606/4885MEN1 3597/4885
US-20170298022-A1 Diamino-Pyridine, Pyrimidine, and Pyridazine Modulators of the Histamine H4 Receptor HRH4, HRH3, HRH1 GAA 4495/4885KMT2A 1207/4885MEN1 3316/4885
US-20100009987-A1 AMINOTHIAZOLE DERIVATIVES AS INHIBITORS OF MARK MAPT, MARK4, MARK3 GAA 1851/4885KMT2A 610/4885MEN1 4234/4885
US-20190106433-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C PRKX, PRKCQ, PRKACA GAA 2759/4885KMT2A 1428/4885MEN1 3225/4885
US-10954251-B2 Thienopyrimidine inhibitors of atypical protein kinase C PRKX, PRKCQ, PRKACA GAA 2759/4885KMT2A 1428/4885MEN1 3225/4885
US-20170158706-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C PRKCQ, PRKDC, PRKACA GAA 3362/4885KMT2A 1606/4885MEN1 3597/4885

“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.