SCHEMBL316378

SCHEMBL316378

COC(Br)C(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 4/20 0.46
CYP3A4 P08684 1/20 0.46
CES2 O00748 3/20 0.45
CES1 P23141 3/20 0.45
LMNA P02545 3/20 0.45
CYP1A2 P05177 1/20 0.44
TP53 P04637 1/20 0.44
HTT P42858 2/20 0.43
PGR P06401 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
HTR2A P28223 1/20 0.43
HRH1 P35367 1/20 0.43
KCNH2 Q12809 1/20 0.43
MDM2 Q00987 1/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 3/20 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
SCHEMBL8103349 0.88 GSK3B (0.61) TSHRTDP1L3MBTL1CYP3A4CES1
SCHEMBL8103346 0.84 NPC1 (0.43) TSHRL3MBTL1ALDH1A1CYP3A4LMNA
SCHEMBL3702935 0.81 TSHR (0.50) TSHRTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL5681872 0.80 ALDH1A1 (0.64) ALDH1A1CES2CES1LMNACYP1A2
SCHEMBL10752669 0.80 PARP10 (0.52) TSHRTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL27520267 0.80 CA1 (0.53) TSHRTDP1L3MBTL1ALDH1A1KMT2A
SCHEMBL11442931 0.80 PGR (0.44) TSHRTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL9840012 0.80 ALDH1A1 (0.61) TSHRTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL3703925 0.80 TDP1 (0.56) TSHRTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL5026930 0.79 PGR (0.47) TSHRTDP1L3MBTL1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036642-A Methyl pinonate thiazole hydrazone derivative and preparation method and application thereof 江西农业大学 2026-05-15 CN claimed
CN-116769741-B Fusion protein composition and synthesis method of double-enzyme immobilized PHA microsphere and beta-hydroxy sulfone 河北牧群生物科技有限公司 2024-06-18 CN claimed
CN-115557865-B Thioether-promoted cysteine-based bioconjugate method 南京工业大学 2024-05-14 CN claimed
CN-116769741-A Fusion protein composition and synthesis method of double-enzyme immobilized PHA microsphere and beta-hydroxy sulfone 河北牧群生物科技有限公司 2023-09-19 CN claimed
CN-115557865-A Thioether-promoted cysteine-based bioconjugation method 南京工业大学 2023-01-03 CN claimed
CN-113880786-A Synthesis method and antioxidant application of camphene aldehyde thiazole hydrazone derivative 江西农业大学 2022-01-04 CN claimed
CN-110305048-A One kind preparing α-sulfuryl ketone compounds synthetic method by α, α-two bromo ketone one kettle way 温州大学 2019-10-08 CN claimed
CN-105061356-A Synthetic method of 2-amino-5-arylthiazole SHANGHAI RAINBOW CHEMISTRY CO LTD 2015-11-18 CN claimed
EP-0143711-B1 DERIVATIVES OF N-(METHOXYPHENACYL)AMINE, THEIR THERAPEUTICAL USE AND PROCESS FOR THEIR PREPARATION LABORATOIRE L. LAFON Société anonyme dite: (FR) 1987-08-12 EP claimed
CN-122036642-A Methyl pinonate thiazole hydrazone derivative and preparation method and application thereof 江西农业大学 2026-05-15 CN disclosed
EP-3810143-B1 NADPH OXIDASE INHIBITORS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND APPLICATION THEREOF TAIWANJ PHARMACEUTICALS CO LTD (TW) 2025-04-16 EP disclosed
CN-118480006-A Novel pyridazinone compound and preparation method and application thereof 郑州大学 2024-08-13 CN disclosed
CN-116769741-B Fusion protein composition and synthesis method of double-enzyme immobilized PHA microsphere and beta-hydroxy sulfone 河北牧群生物科技有限公司 2024-06-18 CN disclosed
CN-116947743-A Nitrosothiol compound and synthesis method and application thereof 南京雷正医药科技有限公司 2023-10-27 CN disclosed
EP-0016277-A1 2-Carbonyl-3-hydroxy-alkenonitriles, their use as anti-arthritic agents and processes for their preparation AMERICAN CYANAMID COMPANY (US) 1980-10-01 EP disclosed
US-4181677-A ANTIINFLAMMATORY AGENTS AMERICAN CYANAMID COMPANY (US) 1980-01-01 US disclosed
US-4173650-A ANTIARTHRITIC AGENTS AMERICAN CYANAMID COMPANY (US) 1979-11-06 US disclosed
US-4024273-A Coronary vasodilator and anti-anginal compositions comprising substituted benzofurans and benzothiophenes and methods of producing coronary vasodilation and anti-anginal activity SMITHKLINE CORPORATION (US) 1977-05-17 US disclosed
US-4001426-A HAVING CORONARY VASODILATOR ACTIVITY SMITHKLINE CORPORATION (US) 1977-01-04 US disclosed
US-3947470-A CORONARY VASODILATORS, TREATMENT OF ANGINA PECTORIS SMITHKLINE CORPORATION (US) 1976-03-30 US disclosed