SCHEMBL3309064

SCHEMBL3309064

N#Cc1ccc(Nc2nc3cccc(NC4CCC(NC(=O)O)CC4)n3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN2 Q96KS0 1/20 0.43
▸ PDE4B Q07343 2/20 0.42
▸ CTSS P25774 1/20 0.41
▸ CTSK P43235 1/20 0.41
▸ TTK P33981 1/20 0.41
▸ PDE4A P27815 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ JAK2 O60674 5/20 0.39
▸ JAK1 P23458 2/20 0.38
▸ CSNK2A1 P68400 2/20 0.38
▸ CSNK2A2 P19784 2/20 0.38
▸ MAP3K5 Q99683 1/20 0.38
▸ CSNK2B P67870 1/20 0.38
▸ JAK3 P52333 2/20 0.37
▸ PTK2 Q05397 1/20 0.37
▸ PRKAA2 P54646 2/20 0.37
▸ ADRA2A P08913 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ EPHX1 P07099 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
SCHEMBL3309067 1.00 EGLN2 (0.43) EGLN2PDE4BCTSSCTSKTTK
SCHEMBL2144032 0.88 PIM1 (0.46) EGLN2CTSSCTSKTTKJAK2
SCHEMBL2144028 0.88 PIM1 (0.46) EGLN2CTSSCTSKTTKJAK2
SCHEMBL13504477 0.87 JAK2 (0.44) EGLN2PDE4BTTKJAK2JAK1
SCHEMBL13504479 0.87 JAK2 (0.44) EGLN2PDE4BTTKJAK2JAK1
SCHEMBL3302615 0.85 SYK (0.43) JAK2JAK1MAP3K5JAK3PTK2
SCHEMBL3302626 0.85 SYK (0.43) JAK2JAK1MAP3K5JAK3PTK2
SCHEMBL3297909 0.83 EGLN2 (0.42) EGLN2CTSSCTSKJAK2JAK1
SCHEMBL2145647 0.79 CDK1 (0.51) CTSSCTSKJAK2CSNK2A1CSNK2A2
SCHEMBL2145651 0.79 CDK1 (0.51) CTSSCTSKJAK2CSNK2A1CSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344494-B1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARM LLC (US) 2016-04-20 — — EP disclosed
US-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BAHMANYAR SOGOLE (US) 2013-01-03 — — US disclosed
US-8299056-B2 Aminotriazolopyridines, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2012-10-30 — — 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 EGLN2 564/4885PDE4B 1861/4885CTSS 3043/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 EGLN2 564/4885PDE4B 1861/4885CTSS 3043/4885

“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.

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