SCHEMBL395853

SCHEMBL395853

CCC(C)c1ccccc1[O]

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
KDM4E B2RXH2 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
ATM Q13315 1/20 0.37
NISCH Q9Y2I1 1/20 0.37
RORC P51449 1/20 0.37
HTT P42858 2/20 0.36
PPARA Q07869 1/20 0.36
PKM P14618 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36

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
SCHEMBL994607 0.85 TSHR (0.73) TSHRGABRA1GABRB2KDM4EL3MBTL1
SCHEMBL202737 0.83 TSHR (0.58) TSHRGABRA1GABRB2KDM4EL3MBTL1
SCHEMBL2697157 0.82 TSHR (0.42) TSHRGABRA1GABRB2
SCHEMBL2048540 0.80 TSHR (0.50) TSHRGABRA1GABRB2KDM4EL3MBTL1
Hydrogen Peroxide SCHEMBL3675725 0.80 TSHR (0.74) TSHRGABRA1GABRB2KDM4EL3MBTL1
SCHEMBL3627333 0.79 TSHR (0.59) TSHRGABRA1GABRB2KDM4EL3MBTL1
SCHEMBL2697041 0.79 TSHR (0.39) TSHRPPARA
SCHEMBL2258718 0.79 TSHR (0.59) TSHRGABRA1GABRB2KDM4EPPARA
SCHEMBL10489460 0.79 TSHR (0.59) TSHRGABRA1GABRB2KDM4EPPARA
SCHEMBL9621456 0.78 TSHR (0.64) TSHRGABRA1GABRB2KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410239-A Heteroatom-containing metallocene compound and preparation method and application thereof 惠生(中国)投资有限公司 2023-07-11 CN claimed
CN-110818545-B Method for preparing substituted aryl ketone by ketone arylation 上海化工研究院有限公司 2022-12-09 CN claimed
CN-110922286-B Asymmetric aryl substituted fulvene compound and preparation method and application thereof 上海化工研究院有限公司 2022-08-16 CN claimed
CN-110922286-A Asymmetric aryl substituted fulvene compound and preparation method and application thereof 上海化工研究院有限公司 2020-03-27 CN claimed
CN-110818545-A Method for preparing substituted aryl ketone by ketone arylation 上海化工研究院有限公司 2020-02-21 CN claimed
EP-0573182-B1 Process for extracting metal values AVECIA LTD (GB) 2000-01-05 EP claimed
US-5557003-A SOLVENT EXTRACTION OF ZINC FROM ORE ZENECA LIMITED (GB) 1996-09-17 US claimed
US-5433855-A Solvent extraction ZENECA LIMITED (GB) 1995-07-18 US claimed
CN-113387055-B Film, method for producing film, and bag 住友化学株式会社 2024-06-07 CN disclosed
CN-111655758-B Nucleic acid delivery polymers 国立大学法人东京大学 2024-03-22 CN disclosed
CN-117425653-A Method for producing bipyridine derivative, method for producing macrocyclic compound, method for producing metal complex containing macrocyclic compound as ligand, metal complex, electrode for air battery, and air battery 住友化学株式会社 2024-01-19 CN disclosed
CN-112724302-B Ethylene-alpha-olefin copolymer, process for producing the same, ethylene resin composition, and film 住友化学株式会社 2023-10-31 CN disclosed
CN-116410239-A Heteroatom-containing metallocene compound and preparation method and application thereof 惠生(中国)投资有限公司 2023-07-11 CN disclosed
CN-116194552-A Cyclic phosphazene compounds having oxaphosphaphenanthrene-containing ring structure 株式会社伏见制药所 2023-05-30 CN disclosed
WO-1990010386-A1 ACYLATED POLYAMINES AND APPLICATIONS THEREOF AS VEGETABLE GROWTH REGULATORS ROUSSEL-UCLAF (FR) 1990-09-20 WO disclosed
CN-1040039-A Absorbed the light tight polymer beads of multilayer of non-polymeric acid ROHM & HAAS (US) 1990-02-28 CN disclosed
EP-0351615-A1 Process for the preparation of 4-alkoxy-2-hydroxybenzophenone-5-sulfonic acids BASF Aktiengesellschaft (DE) 1990-01-24 EP disclosed
CN-87100878-A Pyridazinone derivative and preparation thereof and kill insect, kill mite, nematicide, Fungicidal formulations 1987-09-23 CN disclosed
US-4610804-A Anthraquinone dyes and liquid crystal compositions including the same HITACHI, LTD. (JP) 1986-09-09 US disclosed
EP-0120463-A2 Anthraquinone dyes and liquid crystal compositions including the same HITACHI, LTD. (JP) 1984-10-03 EP disclosed