SCHEMBL3196127

SCHEMBL3196127

Nc1ccc(-c2cnc3cc(-c4cccnc4)ccn23)cc1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.71
GABRG2 P18507 1/20 0.62
GABRB3 P28472 1/20 0.62
GABRA3 P34903 1/20 0.62
FLT3 P36888 7/20 0.56
PIK3CA P42336 2/20 0.53
MTOR P42345 2/20 0.53
NEK2 P51955 1/20 0.52
FGFR3 P22607 1/20 0.50
MEN1 O00255 1/20 0.48
PSIP1 O75475 1/20 0.48
AXL P30530 1/20 0.48
MKNK1 Q9BUB5 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
FYN P06241 1/20 0.46

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
SCHEMBL14144197 0.88 KDR (0.70) KDRGABRG2GABRB3GABRA3FLT3
SCHEMBL17556214 0.86 KDR (0.82) KDRFLT3FGFR3
SCHEMBL3379605 0.86 KDR (0.67) KDRGABRG2GABRB3GABRA3FLT3
SCHEMBL3186080 0.85 KDR (0.74) KDRFLT3PIK3CAMTORFGFR3
SCHEMBL5251547 0.83 KDR (1.00) KDRGABRG2GABRB3GABRA3FLT3
SCHEMBL3328696 0.82 KDR (0.80) KDRGABRG2GABRB3GABRA3FLT3
SCHEMBL14144255 0.82 KDR (0.80) KDRGABRG2GABRB3GABRA3FLT3
SCHEMBL16588365 0.81 GABRG2 (0.83) KDRGABRG2GABRB3GABRA3FLT3
SCHEMBL3382949 0.80 FLT3 (0.58) KDRFLT3FGFR3
SCHEMBL3384492 0.79 KDR (0.57) KDRFLT3FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101128461-B Imidazo (1, 2-a) pyridine compounds as VEGF-R2 inhibitors LILLY CO ELI 2010-12-22 CN disclosed
EP-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed
US-7666879-B2 Imidazo[1,2-A]pyridine compounds as VEGF-R2 inhibitors ELI LILLY AND COMPANY (US) 2010-02-23 US disclosed
US-20090227622-A1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS ELI LILLY AND COMPANY 2009-09-10 US disclosed
EP-1904494-A1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS ELI LILLY AND COMPANY (US) 2008-04-02 EP disclosed
CN-101128461-A Imidazo (1, 2-a) pyridine compounds as VEGF-R2 inhibitors LILLY CO ELI (US) 2008-02-20 CN disclosed
WO-2006091671-A1 IMIDAZO (1, 2-A) PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS ELI LILLY AND COMPANY (US) 2006-08-31 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-20090227622-A1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS KDR, FLT1, FLT4 KDR 1/4885GABRG2 852/4885GABRB3 760/4885

“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.