SCHEMBL1801753

SCHEMBL1801753

COc1nc(-c2c[nH]c3ncc(-c4ccccc4)cc23)cs1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CDK8 P49336 3/20 0.59
▸ AXL P30530 3/20 0.59
▸ TNIK Q9UKE5 1/20 0.59
▸ KIT P10721 1/20 0.58
▸ AAK1 Q2M2I8 1/20 0.56
▸ SGK1 O00141 1/20 0.54
▸ CAMKK2 Q96RR4 1/20 0.54
▸ PDPK1 O15530 1/20 0.53
▸ NTRK1 P04629 1/20 0.51
▸ NEK1 Q96PY6 1/20 0.51
▸ CCNT1 O60563 1/20 0.51
▸ CCNA2 P20248 1/20 0.51
▸ CDK2 P24941 1/20 0.51
▸ CDK9 P50750 1/20 0.51
▸ MAP3K11 Q16584 1/20 0.50

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
SCHEMBL1797818 0.89 PDPK1 (0.57) CDK8AXLTNIKKITAAK1
SCHEMBL1799005 0.85 AXL (0.63) CDK8AXLTNIKKITSGK1
SCHEMBL15500802 0.83 CDK8 (0.64) CDK8AXLTNIKKITSGK1
SCHEMBL15500811 0.83 AXL (0.60) CDK8AXLTNIKKITSGK1
SCHEMBL15500801 0.82 AXL (0.59) CDK8AXLTNIKKITSGK1
SCHEMBL15500786 0.80 PDPK1 (0.57) CDK8AXLTNIKKITSGK1
SCHEMBL1796715 0.80 AXL (0.61) CDK8AXLTNIKSGK1CAMKK2
SCHEMBL1799235 0.79 PDPK1 (0.56) CDK8AXLTNIKKITSGK1
SCHEMBL15500792 0.79 CDK8 (0.49) CDK8AXLTNIKKITAAK1
SCHEMBL15500901 0.78 KIT (0.69) KITNTRK1NEK1CCNT1CCNA2

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
US-7951802-B2 Use of 7-azaindoles in the inhibition of c-Jun N-terminal kinase EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-05-31 — — US disclosed
US-20100069358-A1 USE OF 7-AZAINDOLES IN THE INHIBITION OF C-JUN N-TERMINAL KINASE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-18 — — US disclosed
EP-2125801-A1 THE USE OF 7-AZAINDOLES IN THE INHIBITION OF C-JUN N-TERMINAL KINASE Eisai R&D Management Co., Ltd. (JP) 2009-12-02 — — EP disclosed
WO-2008095943-A1 THE USE OF 7-AZAINDOLES IN THE INHIBITION OF C-JUN N-TERMINAL KINASE EISAI R&D MANAGEMENT CO. LTD. (JP) 2008-08-14 — — 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-20100069358-A1 USE OF 7-AZAINDOLES IN THE INHIBITION OF C-JUN N-TERMINAL KINASE MAPK7, MAPKAPK5, MAPK13 CDK8 436/4885AXL 4302/4885TNIK 93/4885

“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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