SCHEMBL2039637

SCHEMBL2039637

C[C@H](c1ccccc1)n1cnc2cnc3ccc(Cl)cc3c21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ATM Q13315 14/20 0.47
CLK1 P49759 4/20 0.43
DYRK1A Q13627 3/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
GABRA6 Q16445 1/20 0.43

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
SCHEMBL2038541 1.00 MEN1 (0.48) MEN1HPGDKMT2AHSD17B10ATM
SCHEMBL10588992 0.84 MEN1 (0.59) MEN1HPGDKMT2AHSD17B10ATM
SCHEMBL2038308 0.75 FGFR1 (0.56) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL405936 0.74 DPP4 (0.47) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL2246082 0.72 TSHR (0.40) MEN1HPGDKMT2AHSD17B10ATM
SCHEMBL2037744 0.71 HCAR1 (0.44) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL2038322 0.70 HCAR1 (0.46) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL2032500 0.69 HCAR1 (0.45) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL2035100 0.69 HCAR1 (0.47) HPGDGABRA1GABRG2GABRB3GABRA5
SCHEMBL2036673 0.68 HCAR1 (0.44) GABRA1GABRG2GABRB3GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7998972-B2 1H-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2011-08-16 US claimed
JP-4707389-B2 2011-06-22 JP claimed
US-20050245562-A1 1h-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2005-11-03 US claimed
EP-1509521-A2 1H-IMIDAZO[4,5-C]QUINOLINE DERIVATIVES IN THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES Novartis AG (CH) 2005-03-02 EP claimed
WO-2003097641-A2 1H-IMIDAZO[4,5-C] QUINOLINE DERIVATIVES IN THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2003-11-27 WO claimed
EP-1509521-B1 1H-IMIDAZO[4,5-C]QUINOLINE DERIVATIVES FOR THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2008-08-20 EP 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-20050245562-A1 1h-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases ABL1, PRKCA, PRKCQ MEN1 2039/4885HPGD 1597/4885KMT2A 814/4885

“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.