SCHEMBL77245

SCHEMBL77245

C#CC(OC(C#C)c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.36
TSHR P16473 2/20 0.36
F2 P00734 1/20 0.36
TRPA1 O75762 1/20 0.34
CYP1A2 P05177 4/20 0.33
CYP3A4 P08684 4/20 0.33
CYP2D6 P10635 4/20 0.33
CYP2C9 P11712 4/20 0.33
KCNA5 P22460 4/20 0.33
CYP2C19 P33261 4/20 0.33
KCNH2 Q12809 4/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2C P18825 1/20 0.33
LMNA P02545 1/20 0.33
HIF1A Q16665 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTR2A P28223 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32

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
SCHEMBL6202004 0.81 IDO1 (0.42) DPP4F2IDO1TDO2IDO2
SCHEMBL6203172 0.81 IDO1 (0.42) DPP4F2IDO1TDO2IDO2
SCHEMBL6202821 0.81 IDO1 (0.42) DPP4F2IDO1TDO2IDO2
SCHEMBL8692714 0.81 THRB (0.40) DPP4TSHRF2CYP3A4ADRA2A
SCHEMBL11085360 0.80 LMNA (0.38) TSHRTRPA1CYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL7232949 0.79 IDO1 (0.44) IDO1TDO2IDO2
Hydrochloric Acid SCHEMBL7227164 0.79 IDO1 (0.44) IDO1TDO2IDO2
SCHEMBL28307068 0.79 SLC6A4 (0.38) DPP4TSHRF2ADRA2AADRA2C
Hydrochloric Acid SCHEMBL7227095 0.79 IDO1 (0.44) IDO1TDO2IDO2
SCHEMBL28396724 0.78 LMNA (0.33) DPP4TSHRF2CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116583516-A Catalyst for benzoxazines 卢森堡科学技术研究院 2023-08-11 CN claimed
CN-115763079-A Aluminum electrolytic capacitor electrolyte with high sparking voltage and high conductivity and preparation method thereof 兰州初鑫新材料有限公司 2023-03-07 CN claimed
CN-115368218-A Method for preparing 4-diaryl methyl substituted phenol compound 湖南理工学院 2022-11-22 CN claimed
CN-115010704-A Diphyllin 4-substituted triazole derivative and preparation method thereof 南通大学 2022-09-06 CN claimed
CN-114989151-A Diphyllin 5-substituted triazole derivative and preparation method thereof 南通大学 2022-09-02 CN claimed
CN-114874088-A Acetylenic acid and preparation method thereof 中国科学院上海高等研究院 2022-08-09 CN claimed
CN-113501835-B Aluminium chloride catalyzed end group alkyne dehydroboronization method 南京林业大学 2022-03-01 CN claimed
CN-113795489-A Benzoxazine monomers and polymer coatings 卢森堡科学技术研究院 2021-12-14 CN claimed
CN-113501835-A Aluminium chloride catalyzed end group alkyne dehydroboronization method 南京林业大学 2021-10-15 CN claimed
CN-111675650-B Preparation method of aromatic vinyl bromide derivative 哈尔滨工业大学(深圳)(哈尔滨工业大学深圳科技创新研究院) 2021-09-03 CN claimed
CN-109096212-B Method for synthesizing 5-I-1,2, 3-triazole compound by water phase one-pot method 河南师范大学 2021-07-13 CN claimed
EP-1502292-A4 POLYMERIC ANTIREFLECTIVE COATINGS DEPOSITED BY PLASMA ENHANCED CHEMICAL VAPOR DEPOSITION BREWER SCIENCE INC (US) 2009-01-21 EP claimed
JP-2005524240-A 2005-08-11 JP claimed
US-6852474-B2 Polymeric antireflective coatings deposited by plasma enhanced chemical vapor deposition BREWER SCIENCE INC. (US) 2005-02-08 US claimed
EP-1502292-A1 POLYMERIC ANTIREFLECTIVE COATINGS DEPOSITED BY PLASMA ENHANCED CHEMICAL VAPOR DEPOSITION Brewer Science, Inc. (US) 2005-02-02 EP claimed
US-20030224586-A1 Polymeric antireflective coatings deposited by plasma enhanced chemical vapor deposition BREWER SCIENCE, INC. 2003-12-04 US claimed
WO-2003094213-A1 POLYMERIC ANTIREFLECTIVE COATINGS DEPOSITED BY PLASMA ENHANCED CHEMICAL VAPOR DEPOSITION BREWER SCIENCE, INC. (US) 2003-11-13 WO claimed
EP-0324191-A1 Tert.-butyl alkynols BASF Aktiengesellschaft (DE) 1989-07-19 EP claimed
JP-1213250-A None JP disclosed
US-3950433-A 1-Phenyl-1-p-propargyloxyphenyl-2-nitro-ethane derivatives CIBA-GEIGY CORPORATION (US) 1976-04-13 US disclosed