SCHEMBL2773115

SCHEMBL2773115

CC(C)(C)C(CBr)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ TSHR P16473 3/20 0.42
▸ MAPT P10636 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ HMGCR P04035 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ TBXA2R P21731 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ SLC7A5 Q01650 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ TRPA1 O75762 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL3189905 0.80 ALDH1A1 (0.33) ALDH1A1TSHRMAPTPTGS1CHRM1
SCHEMBL28651642 0.78 SLC1A3 (0.36) ALDH1A1TSHRMAPTPTGS1HMGCR
SCHEMBL9021784 0.77 HSPD1 (0.36) ALDH1A1TSHRRECQLCHRM1ADRA1A
SCHEMBL12891264 0.76 CA2 (0.41) ALDH1A1TSHRMAPTPTGS1HMGCR
SCHEMBL2631146 0.76 CA2 (0.41) ALDH1A1TSHRMAPTPTGS1HMGCR
SCHEMBL667279 0.76 OR51E2 (0.39) ALDH1A1TSHRMAPTPTGS1HMGCR
SCHEMBL276534 0.76 CA2 (0.41) ALDH1A1TSHRMAPTPTGS1HMGCR
SCHEMBL13316605 0.76 OR51E2 (0.39) ALDH1A1TSHRMAPTPTGS1HMGCR
SCHEMBL9107333 0.75 HSPD1 (0.39) ALDH1A1TSHRMAPTRECQLCA2
SCHEMBL8979255 0.74 ALDH1A1 (0.32) ALDH1A1TSHRMAPTPTGS1HMGCR

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4634184-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING KINASES VIA UBIQUITIN PROTEOSOME PATHWAY Crossfire Oncology Holding B.V. (NL) 2025-10-22 — — EP disclosed
WO-2025064788-A2 CCR5 CONJUGATES AND USES THEREOF CIDARA THERAPEUTICS, INC. (US) 2025-03-27 — — WO disclosed
US-20250074911-A1 MACROCYCLIC BTK INHIBITORS CROSSFIRE ONCOLOGY HOLDING B.V. (NL) 2025-03-06 — — US disclosed
EP-4448521-A1 REVERSIBLE MACROCYCLIC KINASE INHIBITORS Crossfire Oncology Holding B.V. (NL) 2024-10-23 — — EP disclosed
WO-2024126617-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING KINASES VIA UBIQUITIN PROTEOSOME PATHWAY CROSSFIRE ONCOLOGY HOLDING B.V. (NL) 2024-06-20 — — WO disclosed
WO-2023110936-A1 REVERSIBLE MACROCYCLIC KINASE INHIBITORS NETHERLANDS TRANSLATIONAL RESEARCH CENTER HOLDING B.V (NL) 2023-06-22 — — WO disclosed
US-10759822-B2 Brain-targeting prodrug for AMPA receptor synergist, and pharmaceutical applications thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2020-09-01 — — US disclosed
CN-107286114-B Brain-targeted prodrug of AMPA receptor synergist and medical application thereof 中国人民解放军军事医学科学院毒物药物研究所 2020-08-18 — — CN disclosed
EP-3609870-A1 SUBSTITUTED N-ARYLETHYL-2-AMINOQUINOLINE-4-CARBOXAMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2020-02-19 — — EP disclosed
CN-110357889-A Protein degradation target compound, its antitumor application thereof, wherein mesosome and intermediate application 上海科技大学 2019-10-22 — — CN disclosed
US-20020052370-A1 Cyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PFIZER, INC. 2002-05-02 — — US disclosed
WO-2002002513-A1 CYCLOPENTYL-SUBSTITUTED GLUTARAMIDE DERIVATIVES AS INHIBITORS OF NEUTRAL ENDOPEPTIDASE PFIZER LIMITED (GB) 2002-01-10 — — WO disclosed
WO-2001022966-A1 CASPASES AND APOPTOSIS SMITHKLINE BEECHAM CORPORATION (US) 2001-04-05 — — WO disclosed
EP-1001933-A1 CASPASES AND APOPTOSIS SMITHKLINE BEECHAM CORPORATION (US) 2000-05-24 — — EP disclosed
WO-1999006367-A1 CASPASES AND APOPTOSIS SMITHKLINE BEECHAM CORPORATION (US) 1999-02-11 — — WO disclosed
US-5506262-A ANTICHOLESTEROL AGENTS, FUNGICIDES, ANTICARCINOGENIC AGENTS MERCK & CO., INC. (US) 1996-04-09 — — US disclosed
WO-1994001104-A1 NOVEL CHOLESTEROL LOWERING COMPOUNDS MERCK & CO., INC. (US) 1994-01-20 — — WO disclosed
US-5258401-A Fused ring oxygen compounds, anticholesterol MERCK & CO., INC. (US) 1993-11-02 — — US disclosed
WO-1992020336-A2 NOVEL CHOLESTEROL LOWERING COMPOUNDS MERCK & CO., INC. (US) 1992-11-26 — — WO disclosed
EP-0512865-A2 Novel cholesterol lowering compounds MERCK & CO. INC. (US) 1992-11-11 — — EP 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 (3 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-20020052370-A1 Cyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase ENGASE, ENPEP, CPN1 ALDH1A1 1319/4885TSHR 2123/4885MAPT 3709/4885
US-10759822-B2 Brain-targeting prodrug for AMPA receptor synergist, and pharmaceutical applications thereof GRM3, GRM1, GRM2 ALDH1A1 933/4885TSHR 664/4885MAPT 428/4885
US-20250074911-A1 MACROCYCLIC BTK INHIBITORS BTK, LYN, LCK ALDH1A1 4774/4885TSHR 2394/4885MAPT 4132/4885

“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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