SCHEMBL25399241

SCHEMBL25399241

CC(CNc1ccnc2ccc(N)cc12)NC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.44
▸ PIK3CD O00329 1/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ HCK P08631 1/20 0.44
▸ SRC P12931 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ PIK3CA P42336 1/20 0.44
▸ PIK3CB P42338 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ PIK3CG P48736 1/20 0.44
▸ EPHB4 P54760 1/20 0.44
▸ PRKDC P78527 1/20 0.44
▸ MAP4K4 O95819 1/20 0.38
▸ AAK1 Q2M2I8 5/20 0.38
▸ HTR1A P08908 2/20 0.38
▸ ADRA1D P25100 2/20 0.38
▸ ADRA1A P35348 2/20 0.38
▸ ADRA1B P35368 2/20 0.38
▸ CCNC P24863 1/20 0.37
▸ CDK8 P49336 1/20 0.37

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
SCHEMBL25399239 1.00 EGFR (0.44) EGFRPIK3CDABL1HCKSRC
SCHEMBL30591163 1.00 EGFR (0.44) EGFRPIK3CDABL1HCKSRC
SCHEMBL16585438 0.85 AAK1 (0.48) AAK1HTR1AADRA1DADRA1AADRA1B
SCHEMBL25395841 0.76 HTR1A (0.49) EGFRHTR1AADRA1DADRA1AADRA1B
SCHEMBL25395839 0.76 HTR1A (0.49) EGFRHTR1AADRA1DADRA1AADRA1B
SCHEMBL16585441 0.72 SYK (0.47) AAK1HTR1AADRA1DADRA1AADRA1B
SCHEMBL28216759 0.72 HTR1A (0.50) EGFRHTR1AADRA1DADRA1AADRA1B
SCHEMBL30480750 0.71 SREBF2 (0.40) AAK1
SCHEMBL29053455 0.71 SREBF2 (0.40) AAK1
SCHEMBL644819 0.71 CCNE2 (0.44) AAK1KDM4ECCNE2CCNA2CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250213571-A1 TYK2 INHIBITORS AND USES THEREOF ALUMIS INC. 2025-07-03 — — US disclosed
WO-2023178235-A1 TYK2 INHIBITORS AND USES THEREOF ALUMIS INC. (US) 2023-09-21 — — 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 (1 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-20250213571-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK1, JAK2 EGFR 944/4885PIK3CD 2096/4885ABL1 16/4885

“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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