SCHEMBL20504127

SCHEMBL20504127

c1cc2cc(N3CC4CC(C3)O4)cnc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ AXL P30530 2/20 0.41
▸ CDK8 P49336 1/20 0.41
▸ PIK3CD O00329 3/20 0.40
▸ PIK3CA P42336 2/20 0.40
▸ PIK3CB P42338 1/20 0.40
▸ PIK3CG P48736 1/20 0.40
▸ RIPK1 Q13546 3/20 0.39
▸ LRRK2 Q5S007 1/20 0.38
▸ METAP2 P50579 1/20 0.37
▸ ROCK2 O75116 2/20 0.37
▸ NUDT1 P36639 1/20 0.37
▸ OPRM1 P35372 1/20 0.36
▸ OPRL1 P41146 1/20 0.36
▸ SYK P43405 2/20 0.36
▸ FGFR1 P11362 3/20 0.36
▸ KDR P35968 3/20 0.36
▸ PLK4 O00444 2/20 0.36

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
SCHEMBL20504065 0.93 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL21557997 0.84 MAPT (0.45) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL20503870 0.84 MAPT (0.45) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL20503901 0.84 MAPT (0.45) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL20503902 0.84 MAPT (0.45) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL20503943 0.82 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL20503942 0.82 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL18860575 0.77 KDM4E (0.48) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL856151 0.77 PIK3CA (0.51) SLC6A2SLC6A4SLC6A3AXLCDK8
SCHEMBL18860531 0.76 KDM4E (0.47) SLC6A2SLC6A4SLC6A3AXLCDK8

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 11 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-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 SLC6A2 1708/4885SLC6A4 2114/4885SLC6A3 1580/4885
US-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors MAPKAPK2, MAPK1, MAPK3 SLC6A2 1318/4885SLC6A4 2247/4885SLC6A3 1278/4885
US-20210221809-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS MAPKAPK2, MAPK1, MAPK3 SLC6A2 1318/4885SLC6A4 2247/4885SLC6A3 1278/4885
US-20200283432-A1 ZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS MAPKAPK2, MAPK1, MAPK3 SLC6A2 1708/4885SLC6A4 2114/4885SLC6A3 1580/4885

“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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