SCHEMBL2942285

SCHEMBL2942285

C=CCc1ccccc1B(O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.48
GABRA1 P14867 2/20 0.47
GABRB2 P47870 2/20 0.47
ALDH1A1 P00352 2/20 0.40
ADRB2 P07550 3/20 0.38
ADRB1 P08588 3/20 0.38
LMNA P02545 2/20 0.38
HTR1A P08908 1/20 0.38
ADRB3 P13945 1/20 0.38
ADRA2C P18825 1/20 0.38
SLC6A2 P23975 1/20 0.38
BDKRB2 P30411 1/20 0.38
SLC6A4 P31645 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
KCNH2 Q12809 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38

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
SCHEMBL28289965 0.85 GABRA1 (0.50) LIPGGABRA1GABRB2ALDH1A1ADRB2
SCHEMBL7233310 0.82 GABRA1 (0.61) GABRA1GABRB2ALDH1A1LMNAKDM4E
SCHEMBL5136984 0.82 GABRA1 (0.47) LIPGGABRA1GABRB2ALDH1A1LMNA
SCHEMBL7060007 0.81 LIPG (0.50) LIPGENPP2
SCHEMBL15476145 0.80 LIPG (0.55) LIPGGABRA1GABRB2TSHRENPP2
SCHEMBL11904857 0.79 LIPG (0.48) LIPGGABRA1GABRB2ALDH1A1LMNA
SCHEMBL1158664 0.78 GABRA1 (0.41) GABRA1GABRB2ALDH1A1ADRB2ADRB1
SCHEMBL15476361 0.77 LIPG (0.61) LIPGALDH1A1CYP2D6TSHRENPP2
SCHEMBL9990957 0.77 ALDH1A1 (0.45) LIPGALDH1A1LMNAHTR1AADRA2C
Hydrogen Peroxide SCHEMBL7819301 0.77 GABRA1 (0.58) GABRA1GABRB2ALDH1A1ADRB2ADRB1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108753312-B Liquid crystal compound, preparation method thereof, composition containing liquid crystal compound and high-frequency component containing liquid crystal medium 西安近代化学研究所 2021-07-27 CN claimed
EP-1314727-B1 Direct synthesis of quaternary phenanthridinium salts MERIAL SAS (FR) 2010-09-08 EP claimed
JP-6192240-A None JP disclosed
CN-114044860-B Viscosity-reducing ether polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2023-08-29 CN disclosed
CN-114133493-B Viscosity-reducing ester polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2023-08-25 CN disclosed
CN-112850685-B Two-dimensional carbon material and preparation method and application thereof 厦门稀土材料研究所 2022-10-18 CN disclosed
CN-114133493-A Viscosity-reducing type ester polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2022-03-04 CN disclosed
CN-114044860-A Viscosity reduction type ether polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2022-02-15 CN disclosed
CN-108753312-B Liquid crystal compound, preparation method thereof, composition containing liquid crystal compound and high-frequency component containing liquid crystal medium 西安近代化学研究所 2021-07-27 CN disclosed
CN-112850685-A Two-dimensional carbon material and preparation method and application thereof 厦门稀土材料研究所 2021-05-28 CN disclosed
CN-108517217-B Acetylene liquid crystal compound, preparation method thereof, composition containing acetylene liquid crystal compound and high-frequency component containing acetylene liquid crystal medium 西安近代化学研究所 2020-02-14 CN disclosed
EP-1414955-B1 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION PERKINELMER LIFE SCIENCES INC (US) 2008-08-20 EP disclosed
EP-1414955-A4 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION PERKINELMER LIFE SCIENCES INC (US) 2004-10-06 EP disclosed
EP-1414955-A2 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION Perkinelmer Life Sciences, Inc. (US) 2004-05-06 EP disclosed
US-6617125-B2 Reacting conjugate comprising detectably labeled phenol-containing molecule with peroxidase enzyme; for detection of cytomegalovirus using cyanide-3 tyramide enhanced with 4-thioanisole boronic acid PERKINELMER LIFE SCIENCES, INC. 2003-09-09 US disclosed
US-20030017460-A1 Compositions for enhanced catalyzed reporter deposition PERKINELMER LIFE SCIENCES, INC. 2003-01-23 US disclosed
WO-2003002733-A2 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION PERKINELMER LIFE SCIENCES, INC. (US) 2003-01-09 WO disclosed
JP-H06192240-A BENZENEBORINIC ACID DERIVATIVE, PREPARATION THEREOF AND USE THEREOF AS SYNTHETIC INTERMEDIATE SYNTHELABO SA 1994-07-12 JP disclosed