SCHEMBL2883680

SCHEMBL2883680

COc1ccccc1-c1c(-c2ccncc2)[nH]c2cccnc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.60
RAF1 P04049 5/20 0.54
DYRK1A Q13627 5/20 0.54
PDE5A O76074 2/20 0.51
AURKA O14965 1/20 0.51
GCGR P47871 1/20 0.47
TUBB4A P04350 2/20 0.46
TUBB P07437 2/20 0.46
TUBA3C P0DPH7 2/20 0.46
TUBA1B P68363 2/20 0.46
TUBA4A P68366 2/20 0.46
TUBB4B P68371 2/20 0.46
TUBB3 Q13509 2/20 0.46
TUBB2A Q13885 2/20 0.46
TUBB8 Q3ZCM7 2/20 0.46
TUBA3E Q6PEY2 2/20 0.46
TUBA1A Q71U36 2/20 0.46
TUBA1C Q9BQE3 2/20 0.46
TUBB6 Q9BUF5 2/20 0.46
TUBB2B Q9BVA1 2/20 0.46

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
SCHEMBL2888892 0.83 MAPK14 (0.60) MAPK14RAF1DYRK1AGAAMET
SCHEMBL2287532 0.78 MAPK14 (0.76) MAPK14RAF1DYRK1AMET
SCHEMBL27806875 0.78 MAPK14 (0.56) MAPK14RAF1DYRK1AMET
SCHEMBL30743377 0.77 EGFR (0.43) RAF1DYRK1APDE5AAURKAPDE10A
SCHEMBL2891163 0.77 MAPK14 (0.58) MAPK14RAF1DYRK1AAURKAGCGR
SCHEMBL27784852 0.75 MAPK14 (0.75) MAPK14RAF1DYRK1AMET
SCHEMBL284987 0.75 MAPK14 (1.00) MAPK14RAF1DYRK1AMET
SCHEMBL5257523 0.73 PDE5A (0.52) PDE5AAURKASMN1; SMN2TP53PDE10A
SCHEMBL29865441 0.73 PDE5A (0.52) PDE5AAURKASMN1; SMN2TP53PDE10A
SCHEMBL2888503 0.73 MAPK14 (0.64) MAPK14RAF1DYRK1AMET

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100184598-A1 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-07-22 US claimed
CN-101784191-A 4-aza indole derivatives and their use as fungicides SYNGENTA PARTICIPATIONS AG 2010-07-21 CN claimed
US-8084395-B2 4-aza indole derivatives and their use as fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-12-27 US disclosed
US-20100184598-A1 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-07-22 US disclosed
CN-101784191-A 4-aza indole derivatives and their use as fungicides SYNGENTA PARTICIPATIONS AG 2010-07-21 CN 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-20100184598-A1 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES IDO1, INMT, AZI2 MAPK14 512/4885RAF1 2271/4885DYRK1A 2962/4885

“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.