SCHEMBL1801418

SCHEMBL1801418

CC1CCC(c2cnc3[nH]cc(-c4csc(C(=O)N5CCOCC5)n4)c3c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 2/20 0.47
▸ MAPK9 P45984 2/20 0.47
▸ MAPK10 P53779 2/20 0.47
▸ HTR2C P28335 2/20 0.46
▸ NTRK1 P04629 2/20 0.45
▸ WDR5 P61964 2/20 0.40
▸ KIT P10721 1/20 0.40
▸ LRRK2 Q5S007 4/20 0.36
▸ JAK2 O60674 2/20 0.35
▸ PLK4 O00444 1/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ ROS1 P08922 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ FLT1 P17948 1/20 0.35
▸ MARK3 P27448 1/20 0.35
▸ FLT4 P35916 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ CLK2 P49760 1/20 0.35
▸ CSNK1G2 P78368 1/20 0.35

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
SCHEMBL1801875 0.91 HTR2C (0.48) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL1802085 0.91 JAK3 (0.39) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL1796067 0.91 MAPK8 (0.56) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL1796068 0.91 MAPK8 (0.56) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL8167686 0.91 MAPK8 (0.56) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL1799521 0.91 MAP3K11 (0.41) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL8176817 0.87 MAPK8 (0.57) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL1799652 0.87 MAPK8 (0.57) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL1799651 0.87 MAPK8 (0.57) MAPK8MAPK9MAPK10HTR2CNTRK1
SCHEMBL1800226 0.87 MAPK8 (0.54) MAPK8MAPK9MAPK10HTR2CNTRK1

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 9 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-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-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
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
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
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 MAPK8 33/4885MAPK9 27/4885MAPK10 28/4885

“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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