SCHEMBL29601600

SCHEMBL29601600

OCCOc1cc2ccc(-c3ccccc3)cc2c(-c2cccc3ccc(-c4ccccc4)cc23)c1OCCO

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 3/20 0.42
MCL1 Q07820 5/20 0.38
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
LMNA P02545 2/20 0.34
GPR84 Q9NQS5 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
TNF P01375 1/20 0.34
HTT P42858 2/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
IDO1 P14902 1/20 0.33

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
SCHEMBL29601896 0.93 IDO1 (0.36) SLC6A9MCL1HSD17B1HSD17B2HTR1D
SCHEMBL29601612 0.88 SLC6A9 (0.42) SLC6A9MCL1HSD17B1HSD17B2LMNA
SCHEMBL28350551 0.88 SLC6A9 (0.47) SLC6A9MCL1HTR1DHTR1BLMNA
SCHEMBL11331409 0.85 HTR1B (0.43) SLC6A9MCL1HTR1DHTR1BGPR84
SCHEMBL29351066 0.85 HTR1B (0.43) SLC6A9MCL1HTR1DHTR1BGPR84
SCHEMBL30497620 0.84 KDM4E (0.48) SLC6A9
SCHEMBL29601474 0.83 IDO1 (0.36) SLC6A9HSD17B1HSD17B2HTR1DHTR1B
SCHEMBL29601571 0.81 CHRNB4 (0.39) SLC6A9MCL1HTR1DHTR1BTNF
SCHEMBL29127414 0.80 IDO1 (0.42) SLC6A9HSD17B1HSD17B2HTR1DHTR1B
SCHEMBL22187726 0.79 ALDH1A1 (0.46) SLC6A9MCL1HTR1DHTR1BIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115461388-B Thermoplastic resin and optical member 帝人株式会社 2024-03-26 CN disclosed
CN-113474321-B Compound having binaphthyl skeleton and method for producing compound having binaphthyl skeleton 帝人株式会社 2023-12-15 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-113330051-B Thermoplastic resin and optical member 帝人株式会社 2023-04-28 CN disclosed
CN-115461388-A Thermoplastic resin and optical component 帝人株式会社 2022-12-09 CN disclosed
CN-111655754-B Polyester resin or polyester carbonate resin and optical member using the same 帝人株式会社 2022-08-19 CN disclosed
CN-110741030-B Thermoplastic resin and optical member 帝人株式会社 2022-06-17 CN disclosed
CN-114375313-A Thermoplastic resin and optical member comprising the same 帝人株式会社 2022-04-19 CN disclosed