SCHEMBL9959335

SCHEMBL9959335

Cc1cc(-c2n[nH]c3ccc(C(N)=O)cc23)ccn1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 13/20 0.62
MAP2K4 P45985 4/20 0.62
MAPKAPK3 Q16644 2/20 0.62
MAPK6 Q16659 2/20 0.62
MAPKAPK2 P49137 1/20 0.62
MAPKAPK5 Q8IW41 1/20 0.62
MAPK3 P27361 5/20 0.58
TTK P33981 1/20 0.55
MAPK8 P45983 1/20 0.55

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
SCHEMBL23050281 0.88 MAPK1 (0.62) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2
SCHEMBL9987156 0.88 MAPK1 (0.62) MAPK1MAP2K4MAPKAPK3MAPK6MAPK3
SCHEMBL12074349 0.84 TTK (0.57) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2
SCHEMBL12074347 0.84 MAPK1 (0.58) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2
SCHEMBL23050172 0.83 MAPK1 (0.58) MAPK1MAPK3
SCHEMBL29511803 0.83 MAPK1 (0.58) MAPK1MAPK3
SCHEMBL8437332 0.82 MAP2K4 (0.84) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2
SCHEMBL9987358 0.82 MAPK1 (0.66) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2
SCHEMBL21338430 0.82 MAPK1 (0.53) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2
SCHEMBL23559721 0.80 MAP2K4 (0.58) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2

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
EP-2654748-A1 INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS Merck Sharp & Dohme Corp. (US) 2013-10-30 EP claimed
WO-2012087772-A1 INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS SCHERING CORPORATION (US) 2012-06-28 WO claimed
EP-3337787-B1 1H-PYRAZOLO[3,4-B]PYRIDINE, 1H-THIENO[2,3-C]PYRAZOLE AND 1H-INDAZOLE CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS EXTRACELLULAR SIGNAL-REGULATED KINASES (ERK) INHIBITORS FOR TREATING CANCER JS INNOPHARM SHANGHAI LTD (CN) 2021-03-03 EP disclosed
EP-2654748-B1 INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS MERCK SHARP & DOHME (US) 2016-07-27 EP disclosed
US-9351965-B2 Indazole derivatives useful as ERK inhibitors MERCK SHARP & DOHME CORP. (US) 2016-05-31 US disclosed
US-20130261125-A1 INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS MERCK SHARP & DOHME LLC 2013-10-03 US disclosed
WO-2011163330-A1 NOVEL HETEROCYCLIC COMPOUNDS AS ERK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-12-29 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-20130261125-A1 INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS MAPK3, MAPK1, MAP3K1 MAPK1 2/4885MAP2K4 164/4885MAPKAPK3 5/4885

“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.