SCHEMBL3304396

SCHEMBL3304396

N#Cc1cc(Nc2nc3ccnc(-c4ccccc4)n3n2)ccc1F

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.50
▸ JAK2 O60674 6/20 0.45
▸ GRM4 Q14833 1/20 0.43
▸ EGLN2 Q96KS0 1/20 0.41
▸ KDR P35968 6/20 0.40
▸ CDK1 P06493 2/20 0.39
▸ FLT3 P36888 1/20 0.39
▸ GSK3B P49841 3/20 0.38
▸ GSK3A P49840 1/20 0.37

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
SCHEMBL3304389 0.92 EGLN2 (0.48) ABCG2JAK2EGLN2KDRCDK1
SCHEMBL3308589 0.90 EGLN2 (0.46) ABCG2JAK2GRM4EGLN2KDR
SCHEMBL3304524 0.83 ABCG2 (0.49) ABCG2JAK2EGLN2
SCHEMBL3308062 0.80 JAK2 (0.46) JAK2GSK3B
SCHEMBL3301223 0.79 KDR (0.52) JAK2KDRCDK1
SCHEMBL3300917 0.79 JAK2 (0.45) JAK2KDRGSK3B
SCHEMBL3303037 0.75 EGLN2 (0.42) JAK2EGLN2
SCHEMBL3303925 0.74 JAK2 (0.48) JAK2EGLN2
SCHEMBL3300212 0.74 JAK2 (0.48) JAK2EGLN2FLT3
SCHEMBL3304002 0.74 JAK2 (0.45) JAK2KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BAHMANYAR SOGOLE (US) 2013-01-03 — — US disclosed
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2010-04-15 — — US 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-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 ABCG2 1632/4885JAK2 26/4885GRM4 2998/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 ABCG2 1632/4885JAK2 26/4885GRM4 2998/4885

“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.

Send feedback