SCHEMBL28463245

SCHEMBL28463245

CC(C)(C)C(=O)OCc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNMT P11086 1/20 0.51
▸ NPC1 O15118 5/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ GLA P06280 1/20 0.41
▸ HTR2B P41595 2/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ DRD2 P14416 2/20 0.39
▸ DRD4 P21917 2/20 0.39
▸ DRD3 P35462 2/20 0.39
▸ KMT2A Q03164 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GABRP O00591 1/20 0.37
▸ GABRD O14764 1/20 0.37
▸ GABRA1 P14867 1/20 0.37
▸ GABRB1 P18505 1/20 0.37
▸ GABRG2 P18507 1/20 0.37

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
SCHEMBL7906609 0.88 PNMT (0.50) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL28072512 0.87 PNMT (0.45) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL8473291 0.86 PNMT (0.54) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL1830397 0.85 PNMT (0.57) PNMTNPC1RAB9AALDH1A1KDM4E
Trifluoroacetic Acid SCHEMBL7518687 0.84 PNMT (0.45) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL8671794 0.84 PNMT (0.55) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL1830400 0.84 PNMT (0.55) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL14800329 0.84 PNMT (0.41) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL27221204 0.84 PNMT (0.41) PNMTNPC1RAB9AALDH1A1KDM4E
SCHEMBL4839271 0.83 PNMT (0.51) PNMTNPC1RAB9AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116041580-B Silicon-containing spherical olefin polymerization catalyst component, preparation method and catalyst system 中国石油化工股份有限公司 2024-07-02 — — CN disclosed
CN-116041583-B Catalyst component and catalyst system for olefin polymerization and application thereof 中国石油化工股份有限公司 2024-07-02 — — CN disclosed
CN-117964811-A Catalyst component, catalyst system, application of catalyst system and olefin polymerization method 中国石油化工股份有限公司 2024-05-03 — — CN disclosed
CN-117924555-A Catalyst component, catalyst system, application of catalyst system and olefin polymerization method 中国石油化工股份有限公司 2024-04-26 — — CN disclosed
CN-117924552-A Catalyst component, catalyst system, application and olefin polymerization method 中国石油化工股份有限公司 2024-04-26 — — CN disclosed
CN-116041577-A Olefin polymerization catalyst component, catalyst system, application and olefin polymerization method 中国石油化工股份有限公司 2023-05-02 — — CN disclosed
CN-116041580-A Silicon-containing spherical olefin polymerization catalyst component, preparation method and catalyst system 中国石油化工股份有限公司 2023-05-02 — — CN disclosed
CN-116041583-A Catalyst component and catalyst system for olefin polymerization and application thereof 中国石油化工股份有限公司 2023-05-02 — — CN disclosed
CN-116023547-A Catalyst component, catalyst and method for olefin polymerization 中国石油化工股份有限公司 2023-04-28 — — CN disclosed
CN-107522799-B Spherical carrier, olefin polymerization catalyst, preparation method and application thereof, and olefin polymerization method 中国石油化工股份有限公司 2020-09-15 — — CN disclosed
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