SCHEMBL25824890

SCHEMBL25824890

CC1(C)OB(c2c(-c3ccccc3)oc3ccccc23)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.47
LIPG Q9Y5X9 2/20 0.47
ABCG2 Q9UNQ0 4/20 0.44
KDM4E B2RXH2 5/20 0.43
CYP3A4 P08684 5/20 0.43
KMT2A Q03164 4/20 0.43
LMNA P02545 3/20 0.43
MEN1 O00255 3/20 0.43
TP53 P04637 3/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
ABCB1 P08183 2/20 0.43
AR P10275 2/20 0.43
CYP1B1 Q16678 2/20 0.43
CA9 Q16790 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
ALOX15 P16050 2/20 0.43
MAPK1 P28482 2/20 0.43
DDR2 Q16832 1/20 0.43

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
SCHEMBL29598398 1.00 LPL (0.47) LPLLIPGABCG2KDM4ECYP3A4
SCHEMBL25824896 0.83 LPL (0.55) LPLLIPGABCG2KDM4ECYP3A4
SCHEMBL2269326 0.82 LPL (0.40) LPLLIPGKDM4ECYP3A4KMT2A
SCHEMBL16308873 0.79 KMT2A (0.46) ABCG2KDM4ECYP3A4KMT2ALMNA
SCHEMBL25930828 0.78 LPL (0.39) LPLLIPGKDM4ECYP3A4KMT2A
SCHEMBL30311528 0.78 LPL (0.39) LPLLIPGKDM4ECYP3A4KMT2A
SCHEMBL22884234 0.77 LPL (0.43) LPLLIPGABCG2KDM4ECYP3A4
SCHEMBL13901601 0.75 EYA3 (0.40) LPLLIPGABCG2CYP3A4KMT2A
SCHEMBL25929325 0.74 LPL (0.36) LPLLIPGKDM4ECYP3A4KMT2A
SCHEMBL1006183 0.73 LIPG (0.53) LPLLIPGKDM4EMAPK1MAPT

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
WO-2023132488-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-13 WO disclosed
CN-114514225-A Electroactive compounds 杜邦电子公司 2022-05-17 CN disclosed