SCHEMBL29601612

SCHEMBL29601612

OCCOc1cc2cc(-c3ccccc3)ccc2c(-c2cccc3cc(-c4ccccc4)ccc23)c1OCCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 3/20 0.42
HSD17B1 P14061 4/20 0.41
HSD17B2 P37059 4/20 0.41
ESR1 P03372 3/20 0.39
ESR2 Q92731 3/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2B6 P20813 2/20 0.38
CYP2C19 P33261 2/20 0.38
GPR84 Q9NQS5 2/20 0.36
MCL1 Q07820 2/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
MPI P34949 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL29601474 0.93 IDO1 (0.36) SLC6A9HSD17B1HSD17B2ESR1ESR2
SCHEMBL29601571 0.91 CHRNB4 (0.39) SLC6A9CYP2C9CYP2C19MCL1
SCHEMBL29663218 0.88 IDO1 (0.35) SLC6A9HSD17B1HSD17B2GPR84MCL1
SCHEMBL29601600 0.88 SLC6A9 (0.42) SLC6A9HSD17B1HSD17B2GPR84MCL1
SCHEMBL11331409 0.87 HTR1B (0.43) SLC6A9GPR84MCL1KDM4EMEN1
SCHEMBL29351066 0.87 HTR1B (0.43) SLC6A9GPR84MCL1KDM4EMEN1
SCHEMBL21360007 0.86 SLC6A9 (0.47) SLC6A9HSD17B1HSD17B2ESR1ESR2
SCHEMBL29732693 0.84 CYP1A2 (0.38) SLC6A9CYP1A2GPR84MCL1MAPT
SCHEMBL29601896 0.83 IDO1 (0.36) SLC6A9HSD17B1HSD17B2ESR1ESR2
SCHEMBL30327454 0.82 CYP1A1 (0.33) CYP1A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114752053-B Polycarbonate resin, method for producing same, and optical lens 三菱瓦斯化学株式会社 2025-05-30 CN disclosed
CN-115960345-B Polycarbonate resin, method for producing same, and optical lens 三菱瓦斯化学株式会社 2025-05-06 CN disclosed
CN-114716658-B Polycarbonate resin, method for producing same, and optical lens 三菱瓦斯化学株式会社 2024-12-31 CN disclosed
CN-118955256-A Thermoplastic resin, method for producing same, and optical lens 三菱瓦斯化学株式会社 2024-11-15 CN disclosed
CN-115926169-B Method for producing polysiloxane compound, composition, and molded article 三菱瓦斯化学株式会社 2024-03-22 CN disclosed
CN-116457415-A Thermoplastic resin and optical member comprising the same 帝人株式会社 2023-07-18 CN disclosed
CN-111094389-B Polycarbonate resin, method for producing same, and optical lens 三菱瓦斯化学株式会社 2023-07-07 CN disclosed
CN-116348530-A Method for producing polysiloxane, composition containing polysiloxane, and molded body 三菱瓦斯化学株式会社 2023-06-27 CN disclosed
CN-115926169-A Method for producing polycarbonate copolymer and polysiloxane compound, polycarbonate copolymer, polysiloxane compound, composition, and molded article 三菱瓦斯化学株式会社 2023-04-07 CN disclosed
CN-115135631-A Polycyclic aromatic hydrocarbon compound, crystal thereof, and process for producing the same 帝人株式会社 2022-09-30 CN disclosed
CN-114375313-A Thermoplastic resin and optical member comprising the same 帝人株式会社 2022-04-19 CN disclosed