SCHEMBL1798904

SCHEMBL1798904

c1ccc(-c2cnc3[nH]cc(-c4nccs4)c3c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AXL P30530 6/20 0.68
CDK8 P49336 4/20 0.68
TNIK Q9UKE5 1/20 0.68
SGK1 O00141 3/20 0.55
CAMKK2 Q96RR4 1/20 0.55
GSK3B P49841 1/20 0.55
NTRK1 P04629 1/20 0.54
KIT P10721 1/20 0.53
MAP3K11 Q16584 1/20 0.53

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
SCHEMBL1516651 0.89 NTRK1 (0.59) AXLCDK8TNIKNTRK1KIT
SCHEMBL8320561 0.85 CDK8 (0.49) AXLCDK8TNIKNTRK1KIT
SCHEMBL8320044 0.85 CDK8 (0.64) AXLCDK8TNIKNTRK1KIT
SCHEMBL8320108 0.84 MAPK8 (0.63) AXLCDK8TNIKSGK1NTRK1
SCHEMBL12763222 0.84 CDK8 (0.47) AXLCDK8TNIKNTRK1KIT
SCHEMBL13745373 0.83 CAMKK2 (0.62) AXLCDK8TNIKCAMKK2KIT
SCHEMBL12763225 0.83 CCNT1 (0.51) AXLCDK8TNIKNTRK1KIT
SCHEMBL12763221 0.83 CCNT1 (0.48) AXLCDK8TNIKNTRK1KIT
SCHEMBL8941685 0.81 AXL (1.00) AXLCDK8TNIKSGK1CAMKK2
SCHEMBL12762977 0.80 TNIK (0.53) AXLCDK8TNIKNTRK1KIT

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 AXL 4302/4885CDK8 436/4885TNIK 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.