SCHEMBL1699412

SCHEMBL1699412

CC(=O)Cc1ccccc1Br

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
IDO1 P14902 2/20 0.47
CA12 O43570 4/20 0.45
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA9 Q16790 4/20 0.45
RIPK1 Q13546 1/20 0.45
GPR52 Q9Y2T5 1/20 0.45
TAAR1 Q96RJ0 3/20 0.44
KMT2A Q03164 3/20 0.43
RAB9A P51151 2/20 0.43
MAPK8 P45983 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HCRTR2 O43614 1/20 0.43
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 1/20 0.41
PARP10 Q53GL7 1/20 0.41

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
SCHEMBL29577851 1.00 L3MBTL1 (0.49) L3MBTL1IDO1CA12CA1CA2
SCHEMBL20696473 0.84 CA12 (0.44) CA12CA1CA2CA9RIPK1
SCHEMBL6805430 0.84 L3MBTL1 (0.57) L3MBTL1POLBMAPTALDH1A1
SCHEMBL29049638 0.83 GABRA1 (0.45) L3MBTL1IDO1CA12CA1CA2
SCHEMBL1449282 0.82 CA12 (0.47) IDO1CA12CA1CA2CA9
SCHEMBL1778391 0.82 CA12 (0.47) IDO1CA12CA1CA2CA9
SCHEMBL4685384 0.82 TAAR1 (0.47) IDO1CA12CA1CA2CA9
Benzene SCHEMBL10992898 0.81 L3MBTL1 (0.60) L3MBTL1POLBMAPTALDH1A1
SCHEMBL29993025 0.80 L3MBTL1 (0.40) L3MBTL1IDO1CA12CA1CA2
SCHEMBL286410 0.80 AKR1B1 (0.61) CA12CA1CA2CA9GPR52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115490668-B Pyrimidylimidazole compound, preparation method thereof and organic solderability preservative 深圳市贝加电子材料有限公司 2024-04-02 CN claimed
CN-110041282-B Parecoxib sodium related substance, preparation method and application thereof 正大天晴药业集团股份有限公司 2022-05-20 CN claimed
CN-114015342-A Antistatic scratch-resistant automobile paint and preparation method thereof 黄超财 2022-02-08 CN claimed
CN-108863740-B Preparation method of naphthalenone compound 南昌航空大学 2021-04-02 CN claimed
CN-104710256-A Cheap and efficient synthesis method of alpha-hydroxyketone compound UNIV BEIJING 2015-06-17 CN claimed
US-20250381187-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. (US) 2025-12-18 US disclosed
US-20250340516-A1 Isoquinolinones as Modulators of POLRMT PRETZEL THERAPEUTICS, INC. (US) 2025-11-06 US disclosed
US-12440491-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2025-10-14 US disclosed
CN-119638663-A Flavone derivative and microwave preparation method and application thereof 延边大学 2025-03-18 CN disclosed
CN-119409562-A Preparation method of alpha-bromo aromatic ketone compound 丽水学院 2025-02-11 CN disclosed
CN-115975968-B Amine dehydrogenase mutant and application thereof in chiral amine synthesis 中国科学院天津工业生物技术研究所 2024-08-02 CN disclosed
CN-115490668-B Pyrimidylimidazole compound, preparation method thereof and organic solderability preservative 深圳市贝加电子材料有限公司 2024-04-02 CN disclosed
WO-1999040088-A1 HETEROARYL AMIDINES, METHYLAMIDINES AND GUANIDINES AS PROTEASE INHIBITORS, IN PARTICULAR AS UROKINASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1999-08-12 WO disclosed
EP-0626068-A1 LUMINESCENT LANTHANIDE CHELATES WALLAC OY (FI) 1994-11-30 EP disclosed
US-4960798-A Methods for the treatment of angina MCNEILAB, INC. (US) 1990-10-02 US disclosed
US-4898889-A Methods for the treatment of hypertension MCNEILAB, INC. (US) 1990-02-06 US disclosed
US-4742084-A Aralykyl (arylethynyl)aralkyl amines and their use as vasodilators and antihypertensives MCNEILAB, INC. (US) 1988-05-03 US disclosed
US-4661635-A ANTIARRHYTHMIA AGENTS MCNEILAB, INC. (US) 1987-04-28 US disclosed
EP-0146271-A2 Aralykyl (arylethynyl) aralkyl amines for use as vasodilators and antihypertensives McNeilab, Inc. (US) 1985-06-26 EP disclosed
EP-0145361-A2 Acetylene derivatives for the treatment of hypertension and angina McNeilab, Inc. (US) 1985-06-19 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-20250381187-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS L3MBTL1 3825/4885IDO1 4527/4885CA12 3290/4885
US-12440491-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS L3MBTL1 3825/4885IDO1 4527/4885CA12 3290/4885
US-20250340516-A1 Isoquinolinones as Modulators of POLRMT POLRMT, TFAM, UQCRC1 L3MBTL1 1024/4885IDO1 2113/4885CA12 4854/4885

“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.