SCHEMBL1801905

SCHEMBL1801905

CC(C)(C)[Si](C)(C)n1cc(Br)c2cc([C@H]3CC[C@H](N4CCOCC4)CC3)cnc21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.47
MAPK9 P45984 2/20 0.47
MAPK10 P53779 2/20 0.47
IRAK4 Q9NWZ3 16/20 0.40
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
BMPR1B O00238 1/20 0.33
BMPR1A P36894 1/20 0.33
ACVR1B P36896 1/20 0.33
TGFBR1 P36897 1/20 0.33
ACVR1 Q04771 1/20 0.33

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
SCHEMBL1801904 1.00 MAPK8 (0.47) MAPK8MAPK9MAPK10IRAK4CYP3A4
SCHEMBL1797419 0.96 MAPK8 (0.50) MAPK8MAPK9MAPK10IRAK4CYP3A4
SCHEMBL1797416 0.96 MAPK8 (0.50) MAPK8MAPK9MAPK10IRAK4CYP3A4
SCHEMBL1799310 0.83 MAPK8 (0.44) MAPK8MAPK9MAPK10IRAK4BMPR1B
SCHEMBL1799309 0.83 MAPK8 (0.44) MAPK8MAPK9MAPK10IRAK4BMPR1B
SCHEMBL1799514 0.81 MAPK8 (0.44) MAPK8MAPK9MAPK10IRAK4BMPR1B
SCHEMBL1804476 0.81 MAPK8 (0.46) MAPK8MAPK9MAPK10IRAK4BMPR1B
SCHEMBL1804478 0.81 MAPK8 (0.46) MAPK8MAPK9MAPK10IRAK4BMPR1B
SCHEMBL1799516 0.81 MAPK8 (0.44) MAPK8MAPK9MAPK10IRAK4BMPR1B
SCHEMBL1795045 0.81 MAPK8 (0.43) MAPK8MAPK9MAPK10IRAK4BMPR1B

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 7 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
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.