SCHEMBL1375331

SCHEMBL1375331

CC(C)(C)C(=O)Nc1ncccc1C=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.45
ALDH1A1 P00352 1/20 0.45
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 3/20 0.39
POLB P06746 1/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.37
KMT2A Q03164 2/20 0.37
CETP P11597 1/20 0.37
ADORA1 P30542 1/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
CFTR P13569 2/20 0.36

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
SCHEMBL20810670 0.85 L3MBTL1 (0.44) L3MBTL1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL29954898 0.82 TRIM24 (0.46) L3MBTL1TRIM24TRIM33CYP1A2CYP3A4
SCHEMBL306384 0.81 METAP1 (0.44) L3MBTL1ALDH1A1TRIM24TRIM33KDM4E
SCHEMBL7351040 0.80 ALDH1A1 (0.41) L3MBTL1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7351042 0.80 ALDH1A1 (0.41) L3MBTL1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL3713256 0.80 TRIM24 (0.47) L3MBTL1ALDH1A1TRIM24TRIM33CYP1A2
SCHEMBL2556765 0.79 L3MBTL1 (0.46) L3MBTL1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL2601270 0.79 NPC1 (0.52) L3MBTL1ALDH1A1KDM4EPOLBNPC1
SCHEMBL2494002 0.79 RAB9A (0.59) L3MBTL1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL8613491 0.78 L3MBTL1 (0.53) L3MBTL1ALDH1A1CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2245132-B1 ENCAPSULATED BENEFIT AGENT UNILEVER PLC NO 41424 (GB) 2017-10-18 EP claimed
US-12570655-B2 Cysteine covalent modifiers of AKT1 and uses thereof TERREMOTO BIOSCIENCES, INC. (US) 2026-03-10 US disclosed
WO-2025081045-A9 CYSTEINE COVALENT MODIFIERS OF AKT1 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2025-12-26 WO disclosed
US-20250289819-A1 CYSTEINE COVALENT MODIFIERS OF AKT1 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. 2025-09-18 US disclosed
US-20250163079-A1 KRAS INHIBITORS INCYTE CORPORATION 2025-05-22 US disclosed
WO-2025096738-A1 KRAS INHIBITORS INCYTE CORPORATION (US) 2025-05-08 WO disclosed
WO-2025081045-A1 CYSTEINE COVALENT MODIFIERS OF AKT1 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2025-04-17 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor YALE UNIVERSITY (US) 2021-04-06 US disclosed
US-10813939-B2 Bromodomain inhibitor as adjuvant in cancer immunotherapy H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2020-10-27 US disclosed
US-20040038963-A1 Alpha v integrin receptor antagonists MERCK SHARP & DOHME CORP. 2004-02-26 US disclosed
EP-1315501-A1 ALPHA V INTEGRIN RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 2003-06-04 EP disclosed
US-20030069231-A1 Modified aminoacids, pharmaceuticals containing these compounds and method for their production RUDOLF KLAUS (DE) 2003-04-10 US disclosed
US-6410526-B1 BONE DISORDERS; RESTENOSIS; VISION DISORDERS; ANTICHOLESTEROL AGENTS; ANTICANCER, ANTITUMOR AGENTS MERCK & CO., INC. 2002-06-25 US disclosed
US-6344449-B1 HEADACHE AND MORPHINE DEPENDENCE DR. KARL THOMAE GMBH (DE) 2002-02-05 US disclosed
WO-2002007730-A1 ALPHA V INTEGRIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2002-01-31 WO disclosed
US-20010036946-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production RUDOLF KLAUS (DE) 2001-11-01 US disclosed
WO-1991006300-A1 NAPHTHERIDINONE- AND PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING SAME, AND THEIR USES RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-05-16 WO disclosed
US-4906629-A Pyridazinone and pyrazolone compounds, cardiotonic compositions including same, and their uses RORER PHARMACEUTICAL CORPORATION (US) 1990-03-06 US disclosed
US-4866074-A Naphtheridinone- and pyridooxazinone-pyridone compounds, cardiotonic compositions including same, and their uses RORER PHARMACEUTICAL CORPORATION (US) 1989-09-12 US 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 (8 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-10813939-B2 Bromodomain inhibitor as adjuvant in cancer immunotherapy BRDT, BRD4, BRD1 L3MBTL1 1743/4885ALDH1A1 2424/4885TRIM24 612/4885
US-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor MIF, MMP12, CSF1R L3MBTL1 892/4885ALDH1A1 3264/4885TRIM24 288/4885
US-20040038963-A1 Alpha v integrin receptor antagonists ITGAV, ADGRE5, ITGB3 L3MBTL1 1603/4885ALDH1A1 1039/4885TRIM24 2240/4885
US-12570655-B2 Cysteine covalent modifiers of AKT1 and uses thereof AKT1, AKT2, AKT3 L3MBTL1 2110/4885ALDH1A1 3594/4885TRIM24 3414/4885
US-20030069231-A1 Modified aminoacids, pharmaceuticals containing these compounds and method for their production SLC1A5, NEFM, SRMS L3MBTL1 3426/4885ALDH1A1 1704/4885TRIM24 2194/4885
US-20250163079-A1 KRAS INHIBITORS KRAS, NRAS, HRAS L3MBTL1 2591/4885ALDH1A1 2350/4885TRIM24 2826/4885
US-20250289819-A1 CYSTEINE COVALENT MODIFIERS OF AKT1 AND USES THEREOF AKT1, AKT2, AKT3 L3MBTL1 2270/4885ALDH1A1 3008/4885TRIM24 2982/4885
US-20010036946-A1 Modified amino acids, pharmaceuticals containing these compounds and method for their production PTMS, SRMS, OPRM1 L3MBTL1 3323/4885ALDH1A1 2196/4885TRIM24 1809/4885

“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.