SCHEMBL28548919

SCHEMBL28548919

COCCC1=CC(=O)C=CC1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.53
▸ BACE1 P56817 1/20 0.53
▸ ERBB2 P04626 1/20 0.43
▸ MAOA P21397 2/20 0.41
▸ MAOB P27338 2/20 0.41
▸ MEN1 O00255 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ ALOX5 P09917 5/20 0.33
▸ PTGS2 P35354 5/20 0.33
▸ KDR P35968 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
SCHEMBL10600348 0.83 ACHE (0.52) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL9651750 0.80 ACHE (0.55) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL7915011 0.79 ACHE (0.61) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL7617014 0.77 ACHE (0.47) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL5051489 0.76 ACHE (0.70) ACHEBACE1ERBB2MAOAMAOB
Hydrazine SCHEMBL28821631 0.75 ACHE (0.44) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL20087552 0.75 ACHE (0.69) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL28229943 0.74 ACHE (0.68) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL14680383 0.73 ACHE (0.80) ACHEBACE1ERBB2MAOAMAOB
SCHEMBL1533949 0.71 ACHE (0.53) ACHEBACE1ERBB2MAOAMAOB

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-109337590-B Special heat-vulcanized adhesive for shock-insulation high-damping rubber 上海普力通新材料科技有限公司 2021-05-07 — — CN claimed
CN-109337590-B Special heat-vulcanized adhesive for shock-insulation high-damping rubber 上海普力通新材料科技有限公司 2021-05-07 — — CN disclosed
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