SCHEMBL3140863

SCHEMBL3140863

Fc1ccc(CNc2cncc(Cl)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.58
ALDH1A1 P00352 2/20 0.58
HPGD P15428 1/20 0.58
DRD2 P14416 1/20 0.52
HTR2A P28223 1/20 0.52
HRH1 P35367 1/20 0.52
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
PTGS2 P35354 1/20 0.44
KCNH3 Q9ULD8 2/20 0.44
CDK2 P24941 1/20 0.42
VNN1 O95497 1/20 0.42
BRD4 O60885 1/20 0.42
KAT2B Q92831 1/20 0.42

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
SCHEMBL3361755 0.84 DRD2 (0.56) KDM4EALDH1A1HPGDDRD2HTR2A
SCHEMBL3143358 0.83 CDK2 (0.57) KDM4EALDH1A1HPGDDRD2HTR2A
SCHEMBL1192525 0.82 BRAF (0.53)
SCHEMBL5416533 0.81 CLK4 (0.52) KDM4EMEN1KMT2AVNN1
SCHEMBL22792723 0.80 KDM4E (0.54) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL5207658 0.79 CLK4 (0.51) KDM4EALDH1A1CDK2
SCHEMBL22792358 0.78 CDK2 (0.64) ALDH1A1CDK2
SCHEMBL209726 0.77 ALDH1A1 (0.53) ALDH1A1HPGDDRD2VNN1
SCHEMBL1678795 0.76 LTA4H (0.53) ALDH1A1HPGDMEN1KMT2A
SCHEMBL6283187 0.75 MAP4K4 (0.48) MEN1KMT2ACDK2

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
CN-1671696-B Kinase inhibitors YM BIO SCIENCE AUSTRALIA PRIVATE CO LTD 2010-12-08 CN disclosed
EP-1511742-B1 KINASE INHIBITORS CYTOPIA RES PTY LTD (AU) 2010-02-03 EP disclosed
EP-1511742-B1 KINASE INHIBITORS CYTOPIA RES PTY LTD (AU) 2010-02-03 EP disclosed
US-7598272-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2009-10-06 US disclosed
US-7598272-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2009-10-06 US disclosed
US-7598272-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2009-10-06 US disclosed
US-7511047-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2009-03-31 US disclosed
US-7511047-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2009-03-31 US disclosed
US-7511047-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2009-03-31 US disclosed
US-7259179-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2007-08-21 US disclosed
US-7259179-B2 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2007-08-21 US disclosed
US-20070161635-A1 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2007-07-12 US disclosed
US-20070161635-A1 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2007-07-12 US disclosed
US-20070161635-A1 Kinase inhibitors CYTOPIA RESEARCH PTY LTD (AU) 2007-07-12 US disclosed
US-20060270687-A1 Kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2006-11-30 US disclosed
US-20060241112-A1 Such as n-(4-fluorobenzyl)-6-(4-methyl-1H-imidazol-1-yl)pyrazin-2-amine; protein kinase associated disease states YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2006-10-26 US disclosed
CN-1671696-A Kinase inhibitors CYTOPIA PTY LTD (AU) 2005-09-21 CN disclosed
EP-1511742-A1 KINASE INHIBITORS Cytopia PTY Ltd (AU) 2005-03-09 EP disclosed
US-20050004140-A1 Kinase inhibitors YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2005-01-06 US disclosed
WO-2003099811-A1 KINASE INHIBITORS CYTOPIA PTY LTD (AU) 2003-12-04 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 (4 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-20060270687-A1 Kinase inhibitors MAP3K20, MAP3K1, MAP3K19 KDM4E 1738/4885ALDH1A1 3238/4885HPGD 3512/4885
US-20060241112-A1 Such as n-(4-fluorobenzyl)-6-(4-methyl-1H-imidazol-1-yl)pyrazin-2-amine; protein kinase associated disease states MAP4K2, MAP4K5, MAP4K4 KDM4E 1505/4885ALDH1A1 3757/4885HPGD 3545/4885
US-20050004140-A1 Kinase inhibitors MAP3K20, MAP3K1, MAP3K19 KDM4E 1738/4885ALDH1A1 3238/4885HPGD 3512/4885
US-20070161635-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K10 KDM4E 2364/4885ALDH1A1 3695/4885HPGD 3430/4885

“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.