SCHEMBL17873706

SCHEMBL17873706

COCCN1C(=O)c2cc(-c3ccnc(Nc4ccnn4C)c3)sc2C1(C)C

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 19/20 0.55
MAPK3 P27361 1/20 0.55
PIK3C3 Q8NEB9 1/20 0.41
MAPK6 Q16659 5/20 0.38

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
SCHEMBL19373783 0.95 MAPK1 (0.53) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350398 0.92 MAPK1 (0.46) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350403 0.91 MAPK1 (0.46) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350420 0.91 MAPK1 (0.45) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350400 0.91 MAPK1 (0.53) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350426 0.91 MAPK1 (0.47) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19383016 0.91 MAPK1 (0.53) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350401 0.90 MAPK1 (0.54) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350389 0.90 MAPK1 (0.45) MAPK1MAPK3PIK3C3MAPK6
SCHEMBL19350397 0.89 MAPK1 (0.56) MAPK1MAPK3PIK3C3MAPK6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3237420-B1 ERK INHIBITORS LILLY CO ELI (US) 2018-09-26 EP claimed
US-9879029-B2 ERK inhibitors ELI LILLY AND COMPANY (US) 2018-01-30 US claimed
EP-3237420-A1 ERK INHIBITORS Eli Lilly and Company (US) 2017-11-01 EP claimed
WO-2016106009-A1 ERK INHIBITORS ELI LILLY AND COMPANY (US) 2016-06-30 WO claimed
US-20200268897-A1 Phosphatase Binding Compounds and Methods of Using Same YALE UNIVERSITY 2020-08-27 US disclosed
EP-3237420-B1 ERK INHIBITORS LILLY CO ELI (US) 2018-09-26 EP disclosed
US-9879029-B2 ERK inhibitors ELI LILLY AND COMPANY (US) 2018-01-30 US disclosed
US-9879029-B2 ERK inhibitors ELI LILLY AND COMPANY (US) 2018-01-30 US disclosed
US-9879029-B2 ERK inhibitors ELI LILLY AND COMPANY (US) 2018-01-30 US disclosed
EP-3237420-A1 ERK INHIBITORS Eli Lilly and Company (US) 2017-11-01 EP disclosed
US-20170267691-A1 ERK INHIBITORS LILLY CO ELI (US) 2017-09-21 US disclosed
US-20170267691-A1 ERK INHIBITORS LILLY CO ELI (US) 2017-09-21 US disclosed
US-20170267691-A1 ERK INHIBITORS LILLY CO ELI (US) 2017-09-21 US disclosed
WO-2016106009-A1 ERK INHIBITORS ELI LILLY AND COMPANY (US) 2016-06-30 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 (2 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-20200268897-A1 Phosphatase Binding Compounds and Methods of Using Same PPP5C, PPP4C, DUSP26 MAPK1 1118/4885MAPK3 748/4885PIK3C3 1177/4885
US-20170267691-A1 ERK INHIBITORS MAPK4, MAPK1, MAPK3 MAPK1 2/4885MAPK3 3/4885PIK3C3 443/4885

“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.