SCHEMBL139423

SCHEMBL139423

C#CC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.50
CES2 O00748 5/20 0.50
TSHR P16473 3/20 0.50
ALDH1A1 P00352 2/20 0.50
DAO P14920 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
TDP1 Q9NUW8 4/20 0.46
MAPT P10636 3/20 0.46
CYP3A4 P08684 2/20 0.46
CA2 P00918 2/20 0.46
CA4 P22748 2/20 0.46
HSD17B10 Q99714 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA9 Q16790 2/20 0.46
RECQL P46063 2/20 0.46
POLB P06746 1/20 0.46
PARP1 P09874 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL18305918 0.86 SMN1; SMN2 (0.54) ALDH1A1MAPTL3MBTL1MAPK1LMNA
SCHEMBL9776467 0.86 TSHR (0.40) CES1CES2TSHRALDH1A1MAPT
SCHEMBL31599171 0.82 L3MBTL1 (0.46) CES1CES2TSHRALDH1A1DAO
SCHEMBL9169521 0.81 CES1 (0.52) CES1CES2TSHRALDH1A1DAO
SCHEMBL850940 0.81 ALDH1A1 (0.42) CES1CES2TSHRALDH1A1TDP1
SCHEMBL20565887 0.81 PARP10 (0.58) TSHRALDH1A1CA2CA12CA1
SCHEMBL7464184 0.78 CES1 (0.55) CES1CES2TSHRALDH1A1DAO
SCHEMBL10413479 0.78 CES1 (0.55) CES1CES2TSHRALDH1A1DAO
SCHEMBL5143659 0.78 HSP90AA1 (0.57) CES1CES2TSHRALDH1A1DAO
SCHEMBL12060209 0.77 ESR1 (0.52) CES2TSHRALDH1A1TDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3929207-B1 PEPTIDE FTTFTVT FOR USE IN TREATING FIBROSIS UNIV TEXAS (US) 2024-07-17 EP claimed
CN-118291822-A Processing method and application of rare earth 6 series aluminum alloy and profile 苏州创泰合金材料有限公司 2024-07-05 CN claimed
CN-115262031-B Fluorescent chitin nanofiber and preparation method and application thereof 南京林业大学 2024-04-02 CN claimed
EP-4320184-A1 FLAME RETARDANT POLYAMIDE COMPOSITIONS, USES OF SAME AND PROCESSES FOR THE PREPARATION THEREOF ARKEMA FRANCE (FR) 2024-02-14 EP claimed
EP-4320183-A1 FLAME RETARDANT POLYAMIDE COMPOSITIONS, USES OF SAME AND PROCESSES FOR THE PREPARATION THEREOF ARKEMA FRANCE (FR) 2024-02-14 EP claimed
CN-117263933-A Alpha-carboline derivative and synthesis method thereof 湘潭大学 2023-12-22 CN claimed
US-20230215723-A1 METHODS OF MANUFACTURING INTEGRATED CIRCUIT DEVICES USING CARBONYL COMPOUNDS ADEKA CORPORATION (JP) 2023-07-06 US claimed
CN-115262031-A Fluorescent chitin nano-fiber and preparation method and application thereof 南京林业大学 2022-11-01 CN claimed
WO-2022214755-A1 FLAME RETARDANT POLYAMIDE COMPOSITIONS, USES OF SAME AND PROCESSES FOR THE PREPARATION THEREOF ARKEMA FRANCE (FR) 2022-10-13 WO claimed
WO-2022214754-A1 FLAME RETARDANT POLYAMIDE COMPOSITIONS, USES OF SAME AND PROCESSES FOR THE PREPARATION THEREOF ARKEMA FRANCE (FR) 2022-10-13 WO claimed
WO-2003094213-A1 POLYMERIC ANTIREFLECTIVE COATINGS DEPOSITED BY PLASMA ENHANCED CHEMICAL VAPOR DEPOSITION BREWER SCIENCE, INC. (US) 2003-11-13 WO claimed
EP-0645379-B1 Benzoylacetylene derivatives MITSUBISHI CHEM CORP (JP) 1999-03-17 EP claimed
EP-0645379-A2 Benzoylacetylene derivatives Mitsubishi Chemical Corporation (JP) 1995-03-29 EP claimed
EP-0174769-B1 ANTIFUNGAL AZOLE COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-11-21 EP claimed
EP-0146373-B1 PROCESS FOR OXIDIZING ALDEHYDES TO CARBOXYLIC ACIDS Montedison S.p.A. (IT) 1986-11-05 EP claimed
EP-0039903-B1 8-SUBSTITUTED PYRROLIZIDINES AND QUATERNARY AMMONIUM SALTS THEREOF SUNTORY KABUSHIKI KAISHA (JP) 1986-04-09 EP claimed
EP-0079740-B1 ANTHRANILOYLOXYALKANOATES RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1985-11-13 EP claimed
EP-0053017-B1 AMIDE DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-02-20 EP claimed
EP-0045161-B1 AMIDES OF 4-OXO-5-AMIDOHEXANOIC ACID DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-03-14 EP claimed
EP-0099303-A2 Benzothiopyranopyridinones and their salts, their preparation and use as medicaments, and compositions containing them ROUSSEL-UCLAF (FR) 1984-01-25 EP claimed