SCHEMBL15401430

SCHEMBL15401430

Fc1nc(-n2ncc3cnc(Cl)cc32)ccc1I

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 7/20 0.37
PIM3 Q86V86 7/20 0.37
PIM2 Q9P1W9 7/20 0.37
MAP4K1 Q92918 9/20 0.35
CDC7 O00311 1/20 0.33
CDK2 P24941 1/20 0.33
TTBK1 Q5TCY1 3/20 0.32

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
SCHEMBL15400777 0.85 PIM1 (0.38) PIM1PIM3PIM2MAP4K1CDC7
SCHEMBL15400761 0.81 PIM1 (0.39) PIM1PIM3PIM2MAP4K1TTBK1
SCHEMBL15401648 0.78 PIM1 (0.46) PIM1PIM3PIM2MAP4K1
SCHEMBL15400983 0.72 PIM1 (0.46) PIM1PIM3PIM2MAP4K1
SCHEMBL15544052 0.72
SCHEMBL15403672 0.71 IRAK4 (0.53) PIM1PIM3PIM2CDC7CDK2
SCHEMBL24852360 0.69 KHK (0.49) PIM1PIM3PIM2MAP4K1
SCHEMBL31738193 0.69 KHK (0.49) PIM1PIM3PIM2MAP4K1
SCHEMBL15400788 0.67 PIM1 (0.60) PIM1PIM3PIM2
SCHEMBL31543305 0.66 PIM1 (0.39) PIM1PIM3PIM2TTBK1

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
EP-2867232-B1 5-AZAINDAZOLE COMPOUNDS AND METHODS OF USE HOFFMANN LA ROCHE (CH) 2018-08-08 EP disclosed
EP-2867232-B1 5-AZAINDAZOLE COMPOUNDS AND METHODS OF USE HOFFMANN LA ROCHE (CH) 2018-08-08 EP disclosed
US-9434725-B2 5-azaindazole compounds and methods of use F. HOFFMANN-LA ROCHE AG (CH) 2016-09-06 US disclosed
US-9434725-B2 5-azaindazole compounds and methods of use F. HOFFMANN-LA ROCHE AG (CH) 2016-09-06 US disclosed
US-9434725-B2 5-azaindazole compounds and methods of use F. HOFFMANN-LA ROCHE AG (CH) 2016-09-06 US disclosed
US-20140005168-A1 5-AZAINDAZOLE COMPOUNDS AND METHODS OF USE GENENTECH,INC. 2014-01-02 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 (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-20140005168-A1 5-AZAINDAZOLE COMPOUNDS AND METHODS OF USE PIM1, PIM3, PIM2 PIM1 1/4885PIM3 2/4885PIM2 3/4885

“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.