SCHEMBL25447124

SCHEMBL25447124

O=[N+]([O-])c1ccc(N2CC3(CNC3)C2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.58
ADRB1 P08588 1/20 0.58
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.50
POLB P06746 1/20 0.50
CRBN Q96SW2 2/20 0.47
LMNA P02545 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ESRRG P62508 1/20 0.43
GAA P10253 1/20 0.43
AKR1C3 P42330 1/20 0.42

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
SCHEMBL21526328 0.84 SIRT6 (0.64) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL29985984 0.82 MEN1 (0.54) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL17373705 0.81 MAPT (0.59) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL25200165 0.81 MAPT (0.59) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL6824323 0.81 SIRT6 (0.56) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL4290276 0.81 ESRRG (0.63) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL4290270 0.81 ESRRG (0.63) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL22175056 0.80 SIRT6 (0.63) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL17047527 0.80 MAPT (0.53) SIRT6ADRB1MAPTALDH1A1POLB
SCHEMBL7986410 0.79 SIRT6 (0.66) SIRT6ADRB1MAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559492-B2 BRAF degraders C4 THERAPEUTICS, INC. (US) 2026-02-24 US disclosed
EP-4652161-A1 2,4-DIANILINOPYRIMIDINE-BASED AURORA-A KINASE SELECTIVE DEGRADATION INDUCING COMPOUNDS Uppthera, Inc. (KR) 2025-11-26 EP disclosed
WO-2024155112-A1 2,4-DIANILINOPYRIMIDINE-BASED AURORA-A KINASE SELECTIVE DEGRADATION INDUCING COMPOUNDS UPPTHERA, INC. (KR) 2024-07-25 WO disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
EP-4168407-A1 BRAF DEGRADERS C4 Therapeutics, Inc. (US) 2023-04-26 EP disclosed
WO-2022251224-A1 WEE1 INHIBITORS AND METHODS FOR TREATING CANCER RECURIUM IP HOLDINGS, LLC (US) 2022-12-01 WO disclosed
WO-2021255212-A1 BRAF DEGRADERS F. HOFFMANN-LA ROCHE AG (CH) 2021-12-23 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-12559492-B2 BRAF degraders BRAF, NRAS, HRAS SIRT6 3474/4885ADRB1 797/4885MAPT 4613/4885
US-20230145336-A1 BRAF DEGRADERS BRAF, NRAS, RAF1 SIRT6 1837/4885ADRB1 4475/4885MAPT 2440/4885

“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.