SCHEMBL28625538

SCHEMBL28625538

CCc1ccccc1-c1ccc(N=C=O)c(N=C=O)c1CC

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.51
GABRB2 P47870 2/20 0.51
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
CSNK2A1 P68400 1/20 0.35
CSNK2A3 Q8NEV1 1/20 0.35
CYP3A4 P08684 2/20 0.35
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL30950302 0.79 GABRA1 (0.53) GABRA1GABRB2CYP3A4ALDH1A1HPGD
SCHEMBL10435889 0.79 GABRA1 (0.53) GABRA1GABRB2CSNK2A2CSNK2BCSNK2A1
SCHEMBL112108 0.79 GABRA1 (0.53) GABRA1GABRB2CYP3A4ALDH1A1HPGD
SCHEMBL29115553 0.74 GABRA1 (0.47) GABRA1GABRB2CYP3A4ALDH1A1HPGD
SCHEMBL109349 0.74 GABRA1 (0.78) GABRA1GABRB2CYP3A4ALDH1A1HPGD
SCHEMBL10599839 0.73 GABRA1 (0.58) GABRA1GABRB2CYP3A4ALDH1A1HPGD
SCHEMBL6064569 0.72 GABRA1 (0.53) GABRA1GABRB2CYP3A4
SCHEMBL93290 0.71 GABRA1 (0.61) GABRA1GABRB2CYP3A4ALDH1A1HPGD
SCHEMBL29795971 0.71 GABRA1 (0.61) GABRA1GABRB2CYP3A4ALDH1A1HPGD
SCHEMBL112107 0.71 GABRA1 (0.48) GABRA1GABRB2CYP3A4ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113614853-A Electrical insulating resin composition and electrical insulator 昭和电工材料株式会社 2021-11-05 CN disclosed
CN-113228202-A Electrical insulating resin composition and electrical insulator 昭和电工材料株式会社 2021-08-06 CN disclosed