SCHEMBL29501282

SCHEMBL29501282

CC1(C)OB(c2sc3ccccc3c2Cl)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.41
MCL1 Q07820 1/20 0.39
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
GPR3 P46089 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
ALDH1A1 P00352 7/20 0.36
MAPT P10636 6/20 0.36
HPGD P15428 4/20 0.36
LMNA P02545 3/20 0.36
KDM4E B2RXH2 3/20 0.36
GFER P55789 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
OGG1 O15527 1/20 0.36
KMT2A Q03164 5/20 0.35
MEN1 O00255 4/20 0.35
SMN1; SMN2 Q16637 3/20 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
SCHEMBL28995891 1.00 LOXL2 (0.41) LOXL2MCL1LPLLIPGHDAC1
SCHEMBL594378 0.82 LPL (0.39) LPLLIPGGPR3ALDH1A1MAPT
SCHEMBL25930829 0.81 LPL (0.38) LOXL2MCL1LPLLIPGHDAC1
SCHEMBL30311829 0.81 LPL (0.38) LOXL2MCL1LPLLIPGHDAC1
SCHEMBL24702781 0.77 ALDH1A1 (0.49) ALDH1A1MAPTHPGDLMNAKDM4E
SCHEMBL23330795 0.75 LPL (0.39) LPLLIPGGPR3ALDH1A1MAPT
SCHEMBL22303410 0.75 MAPT (0.36) LOXL2MCL1LPLLIPGHDAC1
SCHEMBL22309993 0.74 TNKS (0.35) LOXL2MCL1LPLLIPGGPR3
SCHEMBL22303408 0.74 LOXL2 (0.33) LOXL2MCL1LPLLIPGGPR3
SCHEMBL22310925 0.74 LOXL2 (0.33) LOXL2MCL1LPLLIPGGPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115867555-A Novel compound and organic light emitting device comprising same 株式会社LG化学 2023-03-28 CN disclosed
WO-2022059923-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-03-24 WO disclosed