SCHEMBL3304261

SCHEMBL3304261

Oc1cc(-c2nccc3nc(Nc4ccccc4)nn23)ccn1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 13/20 0.48
LRRK2 Q5S007 2/20 0.46
JAK3 P52333 3/20 0.42
KDR P35968 2/20 0.41
PLK1 P53350 1/20 0.41
CAMK2D Q13557 1/20 0.39
PTK2 Q05397 1/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
PRKCA P17252 1/20 0.39
PRKCD Q05655 1/20 0.39
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38

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
SCHEMBL3306057 0.88 ADORA2A (0.46) JAK2LRRK2JAK3KDRPLK1
SCHEMBL3301223 0.87 KDR (0.52) JAK2LRRK2JAK3KDRPLK1
SCHEMBL2145283 0.86 JAK2 (0.53) JAK2JAK3PTK2
SCHEMBL3304002 0.86 JAK2 (0.45) JAK2LRRK2JAK3KDRPLK1
SCHEMBL3303058 0.83 JAK2 (0.53) JAK2LRRK2JAK3KDRPLK1
SCHEMBL3309507 0.83 JAK2 (0.49) JAK2JAK3KDRPLK1CAMK2D
SCHEMBL3306579 0.83 JAK2 (0.52) JAK2LRRK2JAK3KDRPLK1
SCHEMBL3300201 0.80 JAK2 (0.43) JAK2LRRK2JAK3KDRPLK1
SCHEMBL3302321 0.79 JAK2 (0.42) JAK2LRRK2JAK3KDRPLK1
SCHEMBL3300054 0.79 JAK2 (0.46) JAK2LRRK2JAK3KDRPLK1

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 JAK2 26/4885LRRK2 98/4885JAK3 86/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 JAK2 26/4885LRRK2 98/4885JAK3 86/4885

“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.