SCHEMBL3512283

SCHEMBL3512283

N#Cc1ccc(-c2cc[c]cn2)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.39
CHEK1 O14757 2/20 0.38
SYK P43405 2/20 0.37
PDE10A Q9Y233 1/20 0.35
KDM5B Q9UGL1 1/20 0.34
VHL P40337 1/20 0.34
DGAT1 O75907 1/20 0.34
TRPA1 O75762 1/20 0.34
MTOR P42345 2/20 0.33
PIK3CD O00329 1/20 0.33
ABL1 P00519 1/20 0.33
EGFR P00533 1/20 0.33
HCK P08631 1/20 0.33
SRC P12931 1/20 0.33
KDR P35968 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
EPHB4 P54760 1/20 0.33
PRKDC P78527 1/20 0.33
PI4KB Q9UBF8 1/20 0.33

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
SCHEMBL3516787 0.78 CHEK1 (0.45) EGLN2CHEK1PDE10AKDM5BVHL
SCHEMBL1416453 0.77 KDM1A (0.43) CYP11B2
SCHEMBL194157 0.75 PIK3CD (0.44) PIK3CD
SCHEMBL129622 0.75
SCHEMBL12630708 0.75 CHEK1 (0.51) EGLN2CHEK1PDE10AKDM5BVHL
SCHEMBL18422759 0.75 MYC (0.44) MTOR
SCHEMBL14153223 0.74 CHEK1 (0.55) EGLN2CHEK1
SCHEMBL18422298 0.73 EGLN2 (0.40) EGLN2CHEK1SYKPDE10AKDM5B
SCHEMBL18423224 0.73 EGLN2 (0.38) EGLN2CHEK1SYKPDE10AKDM5B
SCHEMBL2751776 0.72 ALDH1A1 (0.41) CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170033293-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME JNC CORPORATION (JP) 2017-02-02 US disclosed
US-20100305113-A1 Substituted Imidazopyridazines as Lipid Kinase Inhibitors CAPRARO HANS-GEORG 2010-12-02 US disclosed
CN-101754968-A Substituted imidazopyridazines as PI3K lipid kinase inhibitors NOVARTIS AG 2010-06-23 CN disclosed
EP-2155753-A1 SUBSTITUTED IMIDAZOPYRIDAZINES AS PI3K LIPID KINASE INHIBITORS Novartis Ag (CH) 2010-02-24 EP disclosed
WO-2008138834-A1 SUBSTITUTED IMIDAZOPYRIDAZINES AS PI3K LIPID KINASE INHIBITORS NOVARTIS AG (CH) 2008-11-20 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-20100305113-A1 Substituted Imidazopyridazines as Lipid Kinase Inhibitors PI4KA, PIK3CA, PIK3CB EGLN2 2126/4885CHEK1 325/4885SYK 510/4885
US-20170033293-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SLC26A3, SLC9A1, HVCN1 EGLN2 1111/4885CHEK1 4506/4885SYK 4783/4885

“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.