SCHEMBL21961975

SCHEMBL21961975

Cc1ccccc1CCNC(=O)c1ncc(-c2c[nH]c3ncc(N4CCOCC4)cc23)cn1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 9/20 0.53
GSK3B P49841 1/20 0.46
IL2 P60568 1/20 0.44
MAP4K1 Q92918 1/20 0.44
CLK1 P49759 2/20 0.44
DYRK1A Q13627 2/20 0.44
PDE4B Q07343 1/20 0.42
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
SLC2A1 P11166 1/20 0.41
SNCA P37840 1/20 0.41
CAMKK2 Q96RR4 1/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
STK4 Q13043 1/20 0.40
STK3 Q13188 1/20 0.40

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
SCHEMBL21961937 0.91 MAPK1 (0.51) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL21961969 0.90 MAPK1 (0.51) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL22011141 0.88 MAPK1 (0.52) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL31689711 0.88 MAPK1 (0.57) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL21961984 0.88 MAPK1 (0.49) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL22011270 0.88 MAPK1 (0.57) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL22011271 0.86 GSK3B (0.51) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL31689709 0.86 GSK3B (0.51) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL21961944 0.84 SNCA (0.51) MAPK1GSK3BIL2MAP4K1CLK1
SCHEMBL21961959 0.84 MAPK1 (0.49) MAPK1GSK3BIL2MAP4K1CLK1

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
US-12428416-B2 ERK inhibitors and uses thereof CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2025-09-30 US disclosed
US-20220002294-A1 ERK INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-01-06 US disclosed
US-20220002294-A1 ERK INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-01-06 US disclosed
EP-3880677-A1 ERK INHIBITORS AND USES THEREOF California Institute of Technology (US) 2021-09-22 EP disclosed
CN-113423707-A ERK inhibitors and uses thereof 加利福尼亚技术学院 2021-09-21 CN disclosed
WO-2020102686-A1 ERK INHIBITORS AND USES THEREOF CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2020-05-22 WO disclosed
WO-2020102686-A1 ERK INHIBITORS AND USES THEREOF CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2020-05-22 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-20220002294-A1 ERK INHIBITORS AND USES THEREOF MAPKAPK2, MAPK3, MAP4K2 MAPK1 11/4885GSK3B 358/4885IL2 3843/4885
US-12428416-B2 ERK inhibitors and uses thereof MAPKAPK2, MAPK3, MAP4K2 MAPK1 11/4885GSK3B 358/4885IL2 3843/4885

“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.