SCHEMBL30607751

SCHEMBL30607751

CN(C)Cc1cc(Oc2ccc(C=O)cc2)c(CN(C)C)cc1Oc1ccc(C=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 0.51
SLC6A2 P23975 8/20 0.47
SLC6A3 Q01959 8/20 0.47
HTR2A P28223 4/20 0.47
KCNH2 Q12809 1/20 0.46
TTR P02766 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL30663921 0.87 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL5915441 0.77 ALDH1A1 (0.59) TTRALDH1A1
SCHEMBL8544104 0.75 ALDH1A1 (0.45) SLC6A4HTR2AKCNH2TTRALDH1A1
SCHEMBL25273587 0.72 ALDH1A1 (0.58) TTRALDH1A1
SCHEMBL17955067 0.71 TTR (0.81) TTRALDH1A1
SCHEMBL24144608 0.71 ALDH1A1 (0.62) ALDH1A1
SCHEMBL17508149 0.70 TTR (0.69) TTRALDH1A1
SCHEMBL17508233 0.70 CYP2A6 (0.50) TTRALDH1A1
SCHEMBL226655 0.70 ALDH1A1 (0.54) SLC6A4HTR2AKCNH2TTRALDH1A1
SCHEMBL5050902 0.70 PARP10 (0.65) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116920941-B Silica-based catalyst loaded with ionic liquid and preparation method and application thereof 山东海化集团有限公司 2024-01-02 CN claimed
CN-116920940-B Catalyst based on porous organic polymer and preparation method and application thereof 山东海化集团有限公司 2023-12-29 CN claimed
CN-116920948-B Metalloporphyrin-based bifunctional catalyst and preparation method and application thereof 山东海化集团有限公司 2023-12-29 CN claimed
CN-116920941-A Silica-based catalyst loaded with ionic liquid and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN claimed
CN-116920948-A Metalloporphyrin-based bifunctional catalyst and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN claimed
CN-116920940-A Catalyst based on porous organic polymer and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN claimed
CN-116920941-B Silica-based catalyst loaded with ionic liquid and preparation method and application thereof 山东海化集团有限公司 2024-01-02 CN disclosed
CN-116920940-B Catalyst based on porous organic polymer and preparation method and application thereof 山东海化集团有限公司 2023-12-29 CN disclosed
CN-116920940-B Catalyst based on porous organic polymer and preparation method and application thereof 山东海化集团有限公司 2023-12-29 CN disclosed
CN-116920948-B Metalloporphyrin-based bifunctional catalyst and preparation method and application thereof 山东海化集团有限公司 2023-12-29 CN disclosed
CN-116920948-B Metalloporphyrin-based bifunctional catalyst and preparation method and application thereof 山东海化集团有限公司 2023-12-29 CN disclosed
CN-116920941-A Silica-based catalyst loaded with ionic liquid and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN disclosed
CN-116920948-A Metalloporphyrin-based bifunctional catalyst and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN disclosed
CN-116920948-A Metalloporphyrin-based bifunctional catalyst and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN disclosed
CN-116920940-A Catalyst based on porous organic polymer and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN disclosed
CN-116920940-A Catalyst based on porous organic polymer and preparation method and application thereof 山东海化集团有限公司 2023-10-24 CN disclosed