SCHEMBL29601857

SCHEMBL29601857

OCCOc1cc2c(-c3ccccc3)cccc2c(-c2cccc3c(-c4ccccc4)cccc23)c1OCCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.42
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 3/20 0.39
RECQL P46063 1/20 0.39
LMNA P02545 3/20 0.38
HTT P42858 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MCL1 Q07820 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HTR7 P34969 1/20 0.37
POLB P06746 1/20 0.36
KDM4E B2RXH2 3/20 0.36
ADRB2 P07550 2/20 0.35
PLA2G1B P04054 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
SLC6A9 P48067 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
SCHEMBL29601891 0.89 HTR1B (0.42) IDO1ALDH1A1MCL1MEN1KMT2A
SCHEMBL29601376 0.87 IDO1 (0.40) IDO1
SCHEMBL30822053 0.84 HTR1B (0.40) IDO1ALDH1A1MCL1MEN1KMT2A
SCHEMBL28707126 0.82 IDO1 (0.50) IDO1TP53MAPK1RAB9AALDH1A1
SCHEMBL29351066 0.82 HTR1B (0.43) IDO1ALDH1A1MCL1MEN1KMT2A
SCHEMBL11331409 0.82 HTR1B (0.43) IDO1ALDH1A1MCL1MEN1KMT2A
SCHEMBL29601768 0.80 ALDH1A1 (0.44) IDO1TP53MAPK1RAB9AALDH1A1
SCHEMBL27113967 0.80 IDO1 (0.51) IDO1TP53MAPK1RAB9AALDH1A1
SCHEMBL29601600 0.78 SLC6A9 (0.42) IDO1TP53MAPK1RAB9ALMNA
SCHEMBL29601571 0.78 CHRNB4 (0.39) IDO1MCL1SLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-113330051-B Thermoplastic resin and optical member 帝人株式会社 2023-04-28 CN disclosed
CN-114375313-A Thermoplastic resin and optical member comprising the same 帝人株式会社 2022-04-19 CN disclosed