SCHEMBL188362

SCHEMBL188362

Cc1c[c]ccc1N1CCN(C)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 2/20 0.42
DRD2 P14416 4/20 0.40
DRD3 P35462 4/20 0.40
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
PTK2B Q14289 2/20 0.39
MAPK1 P28482 2/20 0.39
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
HTR3A P46098 3/20 0.38
HTR1A P08908 3/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
RAD52 P43351 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 2/20 0.36
GFER P55789 1/20 0.36
ESR2 Q92731 1/20 0.36
HTR3E A5X5Y0 1/20 0.36

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
SCHEMBL16463118 0.87 ADRA2C (0.43) ADRA2CDRD2DRD3MAPTKDM4E
SCHEMBL282852 0.86 GAA (0.38) GAAALDH1A1L3MBTL1EGFR
SCHEMBL2033939 0.85 ALDH1A1 (0.46) MAPTKDM4EGAAPTK2BMAPK1
SCHEMBL606331 0.85 ALDH1A1 (0.41) GAAALDH1A1L3MBTL1
SCHEMBL14940417 0.83 ALDH1A3 (0.45) MAPTGAAPTK2BMAPK1HTT
SCHEMBL4113163 0.81 DRD2 (0.51) ADRA2CDRD2DRD3MAPTKDM4E
SCHEMBL1811539 0.81 ADRB1 (0.32) MAPTGAAPTK2BHTTALDH1A1
SCHEMBL1811536 0.81 MEN1 (0.36) MAPTKDM4EGAAPTK2BALDH1A1
SCHEMBL282584 0.81 KDM4E (0.41) DRD2MAPTKDM4EGAAALDH1A1
SCHEMBL16462683 0.81 GAA (0.53) DRD2DRD3MAPTKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3237407-A1 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS Axikin Pharmaceuticals, Inc. (US) 2017-11-01 EP claimed
US-9730914-B2 3,5-diaminopyrazole kinase inhibitors Axikin Pharmaceuticals (US) 2017-08-15 US claimed
US-20170087131-A1 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS AXIKIN PHARMACEUTICALS, INC. 2017-03-30 US claimed
US-9546163-B2 3,5-diaminopyrazole kinase inhibitors AXIKIN PHARMACEUTICALS, INC. (US) 2017-01-17 US claimed
WO-2016106309-A1 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS AXIKIN PHARMACEUTICALS, INC. (US) 2016-06-30 WO claimed
US-20160176857-A1 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS AXIKIN PHARMACEUTICALS, INC. 2016-06-23 US claimed
JP-4812763-B2 2011-11-09 JP claimed
US-20110152518-A1 Cycloalkyl Substituted Pyrimidinediamine Compounds And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2011-06-23 US claimed
US-7868013-B2 Cycloalkyl substituted pyrimidinediamine compounds and their uses RIGEL PHARMACEUTICALS, INC. (US) 2011-01-11 US claimed
US-7754714-B2 (1S, 2R)-N4-(2-Aminocarbonylcyclopent-1-yl)-5-fluoro-N2-[4-(4-methylpiperazin-1-yl)-3-methylphenyl]-2,4-pyrimidinediamine, having antiproliferative activity, used to inhibit cellular proliferation and to treat proliferate diseases such as cancers RIGEL PHARMACEUTICALS, INC. (US) 2010-07-13 US claimed
US-20080009494-A1 Cycloalkyl Substituted Pyrimidinediamine Compounds And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2008-01-10 US claimed
US-20070299060-A1 Cycloalkyl Substituted Pyrimidinediamine Compounds And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2007-12-27 US claimed
EP-1763514-A2 CYCLOALKYL SUBSTITUTED PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2007-03-21 EP claimed
US-20060035891-A1 Cycloalkyl substituted pyrimidinediamine compounds and their uses MIDCAP FINANCIAL TRUST 2006-02-16 US claimed
WO-2005118544-A2 CYCLOALKYL SUBSTITUTED PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2005-12-15 WO claimed
CN-107250116-B 3, 5-diaminopyrazole kinase inhibitors 艾士盟医疗公司 2020-10-27 CN disclosed
EP-3237407-B1 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS SMA THERAPEUTICS INC (US) 2020-04-15 EP disclosed
EP-1763514-A2 CYCLOALKYL SUBSTITUTED PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2007-03-21 EP disclosed
US-20060035891-A1 Cycloalkyl substituted pyrimidinediamine compounds and their uses MIDCAP FINANCIAL TRUST 2006-02-16 US disclosed
WO-2005118544-A2 CYCLOALKYL SUBSTITUTED PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2005-12-15 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 (6 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-20110152518-A1 Cycloalkyl Substituted Pyrimidinediamine Compounds And Their Uses MKI67, PCNA, TK1 ADRA2C 3804/4885DRD2 3189/4885DRD3 3906/4885
US-20170087131-A1 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS MAP3K13, MAP3K3, PRKAG3 ADRA2C 1873/4885DRD2 4797/4885DRD3 4618/4885
US-20160176857-A1 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS MAP3K13, MAP3K3, PRKAG3 ADRA2C 1873/4885DRD2 4797/4885DRD3 4618/4885
US-20070299060-A1 Cycloalkyl Substituted Pyrimidinediamine Compounds And Their Uses MKI67, PCNA, TK1 ADRA2C 3804/4885DRD2 3189/4885DRD3 3906/4885
US-20080009494-A1 Cycloalkyl Substituted Pyrimidinediamine Compounds And Their Uses MKI67, PCNA, TK1 ADRA2C 3804/4885DRD2 3189/4885DRD3 3906/4885
US-20060035891-A1 Cycloalkyl substituted pyrimidinediamine compounds and their uses MKI67, PCNA, TK1 ADRA2C 3804/4885DRD2 3189/4885DRD3 3906/4885

“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.