SCHEMBL3407645

SCHEMBL3407645

OCc1cc2cccnc2cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.57
CBFB Q13951 1/20 0.52
NR4A2 P43354 1/20 0.49
ALDH1A1 P00352 7/20 0.44
KMT2A Q03164 3/20 0.44
CASP1 P29466 2/20 0.44
MEN1 O00255 2/20 0.44
CASP7 P55210 1/20 0.44
DOT1L Q8TEK3 2/20 0.44
NPC1 O15118 3/20 0.43
POLB P06746 2/20 0.43
RAB9A P51151 2/20 0.43
CCR1 P32246 1/20 0.42
CCR8 P51685 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PDGFRB P09619 1/20 0.42
PDGFRA P16234 1/20 0.42
HTT P42858 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL27835033 0.83 CASP6 (0.57) CASP6CBFBNR4A2ALDH1A1KMT2A
SCHEMBL3584680 0.83 CASP6 (0.57) CASP6CBFBNR4A2ALDH1A1KMT2A
SCHEMBL24368384 0.81 CASP6 (0.51) CASP6NR4A2ALDH1A1KMT2ACASP1
SCHEMBL30174396 0.81 ALDH1A1 (0.46) CASP6NR4A2ALDH1A1KMT2ACASP1
SCHEMBL1161458 0.81 ALDH1A1 (0.46) CASP6NR4A2ALDH1A1KMT2ACASP1
SCHEMBL1750620 0.79 CASP6 (0.71) CASP6NR4A2ALDH1A1KMT2ACASP1
SCHEMBL24368437 0.79 CASP6 (0.53) CASP6NR4A2ALDH1A1KMT2ACASP1
SCHEMBL3586679 0.79 CASP6 (0.53) CASP6NR4A2ALDH1A1KMT2ACASP1
SCHEMBL11102883 0.77 CASP6 (0.54) CASP6NR4A2ALDH1A1KMT2ACASP1
SCHEMBL10368122 0.77 CASP6 (0.62) CASP6NR4A2ALDH1A1KMT2ACASP1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102015716-B Imidazo [1,2-b] pyridazine derivatives for the treatment of C-MET tyrosine kinase mediated disease NOVARTIS AG 2014-09-17 CN disclosed
US-8822468-B2 3-Methyl-imidazo[1,2-b]pyridazine derivatives NOVARTIS AG (CH) 2014-09-02 US disclosed
EP-2265614-A1 IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES FOR THE TREATMENT OF C-MET TYROSINE KINASE MEDIATED DISEASE Novartis AG (CH) 2010-12-29 EP disclosed
US-20090264406-A1 3-METHYL-IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES NOVARTIS AG 2009-10-22 US disclosed
WO-2009106577-A1 IMIDAZO [1,2-B] PYRIDAZINE DERIVATIVES FOR THE TREATMENT OF C-MET TYROSINE KINASE MEDIATED DISEASE NOVARTIS AG (CH) 2009-09-03 WO disclosed
US-20080214455-A1 Novel Chemical Compounds SMITHKLINE BEECHAM CORPORATION 2008-09-04 US disclosed
EP-1879563-A4 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2008-07-16 EP disclosed
EP-1879563-A2 NOVEL CHEMICAL COMPOUNDS Smithkline Beecham Corporation (US) 2008-01-23 EP disclosed
WO-2006132739-A2 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-12-14 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 (2 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-20090264406-A1 3-METHYL-IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES MET, ERBB2, ALK CASP6 2629/4885CBFB 2572/4885NR4A2 2353/4885
US-20080214455-A1 Novel Chemical Compounds HIPK3, HIPK1, HIPK4 CASP6 3301/4885CBFB 3307/4885NR4A2 3824/4885

“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.