SCHEMBL30860930

SCHEMBL30860930

COc1c(NC(=O)OC(C)(C)C)ccc2cnn(C)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
ITGA4 P13612 1/20 0.36
ITGB7 P26010 1/20 0.36
CACNA1H O95180 3/20 0.35
ATR Q13535 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
BRD9 Q9H8M2 1/20 0.34
PIK3CD O00329 1/20 0.34
ABL1 P00519 1/20 0.34
EGFR P00533 1/20 0.34
KDR P35968 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CG P48736 1/20 0.34
BACE1 P56817 1/20 0.34
PRKDC P78527 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
XIAP P98170 1/20 0.34
BIRC2 Q13490 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
SCHEMBL25756633 1.00 GSK3B (0.40) GSK3BDYRK1AITGA4ITGB7CACNA1H
SCHEMBL30895136 0.92 GSK3B (0.36) GSK3BDYRK1AITGA4ITGB7CACNA1H
SCHEMBL31017447 0.92 GSK3B (0.36) GSK3BDYRK1AITGA4ITGB7CACNA1H
SCHEMBL25750456 0.85 GSK3B (0.37) GSK3BDYRK1AITGA4ITGB7PIK3CD
SCHEMBL31017361 0.85 GSK3B (0.37) GSK3BDYRK1AITGA4ITGB7PIK3CD
SCHEMBL25753072 0.85 PIK3CD (0.42) GSK3BDYRK1AATRBRD9PIK3CD
SCHEMBL25672474 0.85 MAPK1 (0.39) GSK3BDYRK1AITGA4ITGB7CACNA1H
SCHEMBL30895142 0.84 MAPK1 (0.38) GSK3BDYRK1AITGA4ITGB7MEN1
SCHEMBL31017347 0.84 MAPK1 (0.38) GSK3BDYRK1AITGA4ITGB7MEN1
SCHEMBL25753440 0.84 GSK3B (0.38) GSK3BDYRK1APIK3CDABL1EGFR

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
US-20250115597-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO LTD (CN) 2025-04-10 US disclosed
US-12129250-B2 TYK2 inhibitors and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-10-29 US disclosed
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. 2024-05-30 US disclosed
US-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-04-18 US disclosed
WO-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 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 (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-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF TYK2, JAK2, JAK1 GSK3B 117/4885DYRK1A 56/4885ITGA4 4193/4885
US-20250115597-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF TYK2, JAK2, JAK1 GSK3B 117/4885DYRK1A 56/4885ITGA4 4193/4885
US-12129250-B2 TYK2 inhibitors and compositions and methods thereof TYK2, JAK2, JAK1 GSK3B 117/4885DYRK1A 56/4885ITGA4 4193/4885
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF LRRK2, MAP3K20, MAP3K5 GSK3B 73/4885DYRK1A 309/4885ITGA4 4664/4885

“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.