SCHEMBL17846016

SCHEMBL17846016

CCn1ncc2cc(Cl)nc(CCCOC[C@@H](N)c3ccccc3)c21

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 10/20 0.39
TACR1 P25103 3/20 0.36
HASPIN Q8TF76 1/20 0.35
SCN4A P35499 5/20 0.34
BCDIN3D Q7Z5W3 1/20 0.34

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
SCHEMBL17846041 0.85 MAPK1 (0.44) MAPK1
SCHEMBL17846043 0.85 MAPK1 (0.44) MAPK1
SCHEMBL17846110 0.84 MAPK1 (0.45) MAPK1
SCHEMBL21219026 0.84 TACR1 (0.36) MAPK1TACR1SCN4A
SCHEMBL17846044 0.84 TACR1 (0.36) MAPK1TACR1SCN4A
SCHEMBL17846091 0.83 MAPK1 (0.38) MAPK1HASPIN
SCHEMBL17846151 0.83 MAPK1 (0.41) MAPK1TACR1HASPINSCN4ABCDIN3D
SCHEMBL20204244 0.83 MAPK1 (0.41) MAPK1TACR1HASPINSCN4ABCDIN3D
SCHEMBL19348976 0.81 MAPK1 (0.42) MAPK1
SCHEMBL17846229 0.81 MAPK1 (0.41) MAPK1

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
EP-3233859-B1 BRIDGED PYRAZOLOPYRIDINE DERIVATIVES AS ERK INHIBITORS USEFUL FOR THE TREATEMENT OF CANCER MERCK SHARP & DOHME (US) 2019-08-07 EP disclosed
US-9988397-B2 ERK inhibitors MERCK SHARP & DOHME CORP. (US) 2018-06-05 US disclosed
EP-3233859-A1 ERK INHIBITORS Merck Sharp & Dohme Corp. (US) 2017-10-25 EP disclosed
US-20170267695-A1 ERK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-09-21 US disclosed
WO-2016100051-A1 ERK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-06-23 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-20170267695-A1 ERK INHIBITORS MAPK1, MAP3K1, MAPK4 MAPK1 1/4885TACR1 1773/4885HASPIN 363/4885

“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.