SCHEMBL3026044

SCHEMBL3026044

Clc1ccn2c(-c3ccnc(-c4ccccc4)c3)cnc2c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.54
FGFR3 P22607 2/20 0.53
CHEK1 O14757 1/20 0.48
GSK3B P49841 1/20 0.48
FLT3 P36888 4/20 0.47
PIM1 P11309 1/20 0.47
FYN P06241 2/20 0.46
BACE1 P56817 1/20 0.45
HPGD P15428 1/20 0.45
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA3 P34903 1/20 0.43
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 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
SCHEMBL3657771 0.95 KDR (0.50) KDRFGFR3CHEK1GSK3BFLT3
SCHEMBL3026012 0.91 KDR (0.55) KDRFGFR3FLT3PIM1FYN
SCHEMBL3021755 0.90 KDR (0.60) KDRFGFR3CHEK1GSK3BFLT3
SCHEMBL3034596 0.87 FLT3 (0.51) KDRFGFR3FLT3FYNGABRG2
SCHEMBL3029117 0.87 GABRG2 (0.53) KDRFGFR3FLT3FYNBACE1
SCHEMBL3033329 0.87 KDR (0.51) KDRFGFR3FLT3FYNBACE1
SCHEMBL3032375 0.86 KDR (0.73) KDRCHEK1GSK3BFLT3FYN
SCHEMBL10174894 0.86 KDR (0.71) KDRFGFR3FLT3BACE1HPGD
SCHEMBL3030180 0.84 GABRA1 (0.59) KDRFGFR3FLT3PIM1HPGD
SCHEMBL3034003 0.83 KDR (0.80) KDRFGFR3CHEK1GSK3BFLT3

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-8367662-B2 Organic compounds NOVARTIS AG (CH) 2013-02-05 US disclosed
EP-2212323-B1 IMIDAZO [1,2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS NOVARTIS AG (CH) 2012-08-15 EP disclosed
US-20100210641-A1 Organic Compounds NOVARTIS AG (CH) 2010-08-19 US disclosed
EP-2212323-A2 IMIDAZO [1,2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS Novartis AG (CH) 2010-08-04 EP disclosed
WO-2009050183-A2 IMIDAZO [1, 2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS NOVARTIS AG (CH) 2009-04-23 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-20100210641-A1 Organic Compounds ALK, ACVR1, ACVRL1 KDR 372/4885FGFR3 32/4885CHEK1 3577/4885

“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.