SCHEMBL31292326

SCHEMBL31292326

CC(C)(C)OC(=O)Nc1ccc(C(C)(C)C#N)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41
▸ DEGS1 O15121 1/20 0.40
▸ BRAF P15056 2/20 0.39
▸ NAMPT P43490 2/20 0.39
▸ GRIN2B Q13224 1/20 0.39
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ BCL2 P10415 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KEAP1 Q14145 1/20 0.38
▸ NFE2L2 Q16236 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ SCN9A Q15858 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
SCHEMBL30099126 0.94 ATR (0.39) HDAC1GSK3BDYRK1ADEGS1BRAF
SCHEMBL23534267 0.86 NAMPT (0.39) HDAC1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL30058570 0.86 NAMPT (0.39) HDAC1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL23535263 0.85 HDAC1 (0.41) HDAC1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL282866 0.84 DEGS1 (0.51) HDAC1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL24738932 0.82 GAA (0.45) HDAC1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL23582651 0.82 GSK3B (0.43) HDAC1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL30828305 0.82 RAB9A (0.55) HDAC1GSK3BDYRK1ADEGS1NPC1
SCHEMBL15057350 0.81 EGLN2 (0.50) GSK3BDYRK1ADEGS1NPC1RAB9A
SCHEMBL29272503 0.80 BRAF (0.44) GSK3BDYRK1ABRAFALDH1A1SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250340528-A1 TARGETED PROTEIN DEGRADATION MONTE ROSA THERAPEUTICS AG (CH) 2025-11-06 — — US disclosed
US-20250243180-A1 TARGETED PROTEIN DEGRADATION MONTE ROSA THERAPEUTICS AG (CH) 2025-07-31 — — US disclosed
WO-2025024521-A1 SUBSTITUTED PIPERIDINEDIONES FOR TARGETED PROTEIN DEGRADATION MONTE ROSA THERAPEUTICS, INC. (US) 2025-01-30 — — 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-20250243180-A1 TARGETED PROTEIN DEGRADATION NEK7, NEK1, RIPK1 HDAC1 2587/4885GSK3B 1530/4885DYRK1A 1412/4885
US-20250340528-A1 TARGETED PROTEIN DEGRADATION NEK7, NEK1, RIPK1 HDAC1 2587/4885GSK3B 1530/4885DYRK1A 1412/4885

“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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