SCHEMBL3416470

SCHEMBL3416470

Cn1cnc2ccc(C(=O)c3cnc4ccc(Cl)nn34)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.50
CHRNA7 P36544 1/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DYRK1A Q13627 9/20 0.37
DYRK2 Q92630 9/20 0.37
DYRK1B Q9Y463 8/20 0.37
DYRK3 O43781 7/20 0.37
CDK5 Q00535 6/20 0.37
CDK5R1 Q15078 6/20 0.37
CCNA2 P20248 5/20 0.37
CDK2 P24941 5/20 0.37
CCNT1 O60563 3/20 0.37
CDK9 P50750 3/20 0.37
TNF P01375 1/20 0.36
TGFBR1 P36897 1/20 0.35
TGFBR2 P37173 1/20 0.35
HSD11B1 P28845 2/20 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
SCHEMBL1163561 0.78 ADORA2A (0.48) ADORA2ANPC1RAB9ADYRK1ADYRK2
SCHEMBL2696311 0.76 DOT1L (0.54) ADORA2ASMN1; SMN2DYRK1ADYRK2DYRK1B
SCHEMBL15562763 0.74 ADORA2A (0.55) ADORA2ANPC1RAB9ADYRK1ADYRK2
SCHEMBL3413202 0.74 ADORA2A (0.55) ADORA2ANPC1RAB9ATNF
SCHEMBL3415847 0.73 MET (0.39) SMN1; SMN2DYRK1ADYRK2DYRK1BDYRK3
SCHEMBL3413630 0.73 MET (0.42) NPC1RAB9ADYRK1ADYRK2DYRK1B
SCHEMBL3409082 0.72 MET (0.46) DYRK1ADYRK2DYRK1BDYRK3CDK5
SCHEMBL3415357 0.72 MET (0.38) NPC1RAB9ADYRK1ADYRK2DYRK1B
SCHEMBL20570515 0.71 CHRNA7 (0.47) CHRNA7NPC1RAB9ATP53SMN1; SMN2
SCHEMBL430630 0.71 TNF (0.50) ADORA2ANPC1RAB9ASMN1; SMN2DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 ADORA2A 995/4885CHRNA7 4253/4885NPC1 4172/4885

“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.