SCHEMBL20504061

SCHEMBL20504061

CC(c1cccc(Cl)c1)n1ccc(B2OC(C)(C)C(C)(C)O2)cc1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ADRA1D P25100 1/20 0.40
▸ MET P08581 1/20 0.39
▸ EGFR P00533 1/20 0.38
▸ LIPG Q9Y5X9 3/20 0.36
▸ LPL P06858 2/20 0.36
▸ KLKB1 P03952 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ JAK2 O60674 1/20 0.34
▸ BTK Q06187 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NR3C2 P08235 2/20 0.32
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ OPRM1 P35372 1/20 0.31
▸ OPRD1 P41143 1/20 0.31
▸ OPRK1 P41145 1/20 0.31
▸ OPRL1 P41146 1/20 0.31

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
SCHEMBL18860566 0.86 MAPK1 (0.46) METEGFRLIPGLPLKLKB1
SCHEMBL20503961 0.84 PTGS1 (0.38) LIPGLPLMAPK1JAK2BTK
SCHEMBL20503922 0.84 MAPK1 (0.37) EGFRLIPGLPLKLKB1MAPK1
SCHEMBL21176822 0.79 BACE1 (0.37) LIPGLPLBACE1IRAK4
SCHEMBL20503924 0.77 AOC3 (0.40) EGFRLIPGLPLKLKB1MAPK1
SCHEMBL20504028 0.74 ADRA1D (0.46) ADRA1DMETMAPK1MEN1KMT2A
SCHEMBL797870 0.73 LIPG (0.51) EGFRLIPGLPLIRAK4
SCHEMBL23714113 0.71 LIPG (0.39) METEGFRLIPGLPLJAK2
SCHEMBL25343856 0.71 EGFR (0.36) EGFRLIPGLPLJAK2BTK
SCHEMBL2573893 0.69 LPL (0.40) LIPGLPLIRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2023-07-25 — — US disclosed
US-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2023-07-25 — — US disclosed
US-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2023-07-25 — — US disclosed
US-20210221809-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV Discovery ENSCM (FR) 2021-07-22 — — US disclosed
US-20210221809-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV Discovery ENSCM (FR) 2021-07-22 — — US disclosed
US-10995089-B2 Zaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2021-05-04 — — US disclosed
US-10995089-B2 Zaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2021-05-04 — — US disclosed
US-20200283432-A1 ZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV Discovery ENSCM (FR) 2020-09-10 — — US disclosed
US-20200283432-A1 ZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV Discovery ENSCM (FR) 2020-09-10 — — US disclosed
EP-3377491-B1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV DISCOVERY (FR) 2019-11-13 — — EP disclosed
EP-3377491-B1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV DISCOVERY (FR) 2019-11-13 — — EP disclosed
EP-3377491-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV Discovery (FR) 2018-09-26 — — EP 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 (4 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-10995089-B2 Zaindole derivatives and their use as ERK kinase inhibitors MAPKAPK2, MAPK1, MAPK3 ADRA1D 846/4885MET 1205/4885EGFR 570/4885
US-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors MAPKAPK2, MAPK1, MAPK3 ADRA1D 1333/4885MET 1296/4885EGFR 600/4885
US-20210221809-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS MAPKAPK2, MAPK1, MAPK3 ADRA1D 1333/4885MET 1296/4885EGFR 600/4885
US-20200283432-A1 ZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS MAPKAPK2, MAPK1, MAPK3 ADRA1D 846/4885MET 1205/4885EGFR 570/4885

“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.

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