SCHEMBL5482557

SCHEMBL5482557

COc1ccc(C)cc1NC(=O)Nc1cccc(-c2cn3ccnc3c(Nc3ccccc3Cl)n2)c1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 17/20 0.72
AURKA O14965 2/20 0.63
KDR P35968 2/20 0.61
TEK Q02763 2/20 0.61
SYK P43405 1/20 0.54

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
SCHEMBL5481502 0.92 EPHB4 (0.76) EPHB4AURKAKDRTEKSYK
SCHEMBL5481621 0.91 EPHB4 (0.76) EPHB4AURKAKDRTEKSYK
SCHEMBL6222200 0.84 EPHB4 (0.69) EPHB4AURKA
SCHEMBL5478469 0.82 EPHB4 (0.64) EPHB4AURKAKDRTEK
SCHEMBL5488557 0.79 EPHB4 (1.00) EPHB4KDRTEK
SCHEMBL5486781 0.77 EPHB4 (0.87) EPHB4KDRTEK
SCHEMBL5475471 0.77 EPHB4 (1.00) EPHB4KDRTEK
SCHEMBL6518188 0.76 EPHB4 (0.73) EPHB4KDRTEK
SCHEMBL5482196 0.76 AURKA (0.79) EPHB4AURKASYK
SCHEMBL5483531 0.76 AURKA (0.70) EPHB4AURKAKDRTEKSYK

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-7312341-B2 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof CGI PHARMACEUTICALS, INC. (US) 2007-12-25 US claimed
US-20040067951-A1 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof GILEAD CONNECTICUT, INC. 2004-04-08 US claimed
WO-2004022562-A1 6-ARYL-IMIDAZO[1,2-a]PYRAZIN-8-YLAMINES, METHOD OF MAKING, AND METHOD OF USE THEREOF CELLULAR GENOMICS, INC. (US) 2004-03-18 WO claimed
US-7312341-B2 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof CGI PHARMACEUTICALS, INC. (US) 2007-12-25 US disclosed
US-20040067951-A1 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof GILEAD CONNECTICUT, INC. 2004-04-08 US disclosed
WO-2004022562-A1 6-ARYL-IMIDAZO[1,2-a]PYRAZIN-8-YLAMINES, METHOD OF MAKING, AND METHOD OF USE THEREOF CELLULAR GENOMICS, INC. (US) 2004-03-18 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-20040067951-A1 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof MAP3K8, PRKACA, MAP3K1 EPHB4 4062/4885AURKA 207/4885KDR 1716/4885

“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.