SCHEMBL2462665

SCHEMBL2462665

CCCOc1ccc(-c2ccc(C#N)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.60
HRH3 Q9Y5N1 7/20 0.56
HRH2 P25021 6/20 0.56
HRH1 P35367 6/20 0.56
MMP3 P08254 5/20 0.56
MMP1 P03956 1/20 0.55
MMP9 P14780 1/20 0.55
MMP13 P45452 1/20 0.55
ALDH1A1 P00352 4/20 0.55
HPGD P15428 3/20 0.55
KDM4E B2RXH2 2/20 0.55
HTT P42858 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MAPT P10636 1/20 0.53
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51

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
SCHEMBL12736275 1.00 MMP2 (0.60) MMP2HRH3HRH2HRH1MMP3
SCHEMBL3276405 0.94 ALDH1A1 (0.58) MMP2HRH3HRH2HRH1MMP3
SCHEMBL8939343 0.92 ALDH1A1 (0.63) MMP2HRH3HRH2HRH1MMP3
SCHEMBL12736277 0.92 ALDH1A1 (0.63) MMP2HRH3HRH2HRH1MMP3
SCHEMBL11124634 0.90 MMP2 (0.54) MMP2HRH3HRH2HRH1MMP3
SCHEMBL25192787 0.89 KDM4E (0.68) MMP2HRH3HRH2HRH1MMP3
SCHEMBL503737 0.89 KDM4E (0.68) MMP2HRH3HRH2HRH1MMP3
SCHEMBL923901 0.89 LTA4H (0.61) MMP2HRH3HRH2HRH1ALDH1A1
SCHEMBL11756180 0.87 KDM4E (0.54) MMP2HRH3HRH2HRH1MMP3
SCHEMBL11760090 0.87 KDM4E (0.54) MMP2HRH3HRH2HRH1MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115639706-B Polymer dispersed liquid crystal device based on zwitterion and preparation method thereof 杭州兵智科技有限公司 2023-04-11 CN claimed
WO-2023005682-A1 METHOD FOR ANALYZING TARGETED EXPOSURE GROUP OF ENVIRONMENTAL POLLUTANTS IN PLASMA, AND USE THEREOF 暨南大学 2023-02-02 WO claimed
CN-115639706-A Polymer dispersed liquid crystal device based on zwitterion and preparation method thereof 杭州兵智科技有限公司 2023-01-24 CN claimed
US-4069167-A 4-CYANO-4\"-N-ALKYLBI- AND TERPHENYLS, 4-CYANO-4\"-N-ALKOXYBIPHENYLS CHISSO CORPORATION (JA) 1978-01-17 US claimed
JP-57063377-A None JP disclosed
JP-57198776-A None JP disclosed
JP-55157676-A None JP disclosed
JP-55155082-A None JP disclosed
JP-55155083-A None JP disclosed
JP-59184276-A None JP disclosed
JP-57198777-A None JP disclosed
CN-119955669-A Gordonia and application thereof 东莞理工学院 2025-05-09 CN disclosed
JP-S55155083-A LIQUID CRYSTAL COLOR DISPLAY COMPOSITION MITSUI TOATSU CHEM INC 1980-12-03 JP disclosed
JP-S55155082-A LIQUID CRYSTAL COLOR DISPLAY COMPOSITION MITSUI TOATSU CHEM INC 1980-12-03 JP disclosed
EP-0014840-A1 Fluorphenyl-trans-cyclohexanes, process for their preparation, liquid crystalline dielectrics containing them and electrooptical displaying means MERCK PATENT GmbH (DE) 1980-09-03 EP disclosed
US-4136053-A BIPHENYL ESTERS AND LIQUID CRYSTALLINE MIXTURES COMPRISING THEM MERCK PATENT GESELLSCHAFT MIT BESCHANKTER HAFTUNG (DE) 1979-01-23 US disclosed
US-4077900-A CYCLIC DIAMINO COMPOUND MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1978-03-07 US disclosed
US-4069167-A 4-CYANO-4\"-N-ALKYLBI- AND TERPHENYLS, 4-CYANO-4\"-N-ALKOXYBIPHENYLS CHISSO CORPORATION (JA) 1978-01-17 US disclosed
US-4065489-A Biphenyl esters and liquid crystalline mixtures comprising them MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-12-27 US disclosed
US-4035060-A Electro-optic device DAINIPPON PRINTING CO., LTD (JA) 1977-07-12 US disclosed