SCHEMBL30229752

SCHEMBL30229752

CC(C)=CCCC1=CCC(COc2ccccc2-c2ccccc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 14/20 0.41
BCL2L1 Q07817 7/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
BCL2 P10415 8/20 0.39
C5AR1 P21730 1/20 0.37
BID P55957 3/20 0.36
BAK1 Q16611 2/20 0.36
PKM P14618 1/20 0.36
FNTA P49354 1/20 0.36
PGGT1B P53609 1/20 0.36

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
SCHEMBL30314566 0.80 ADRB2 (0.37) MCL1BCL2L1MEN1KMT2AALDH1A1
SCHEMBL28551177 0.79 MEN1 (0.40) MCL1BCL2L1MEN1KMT2AALDH1A1
SCHEMBL28559719 0.78 MEN1 (0.39) MCL1BCL2L1MEN1KMT2AALDH1A1
SCHEMBL28992640 0.77 MEN1 (0.34) MEN1KMT2AALDH1A1MAPTPKM
SCHEMBL9414357 0.77 ALDH1A1 (0.43) MCL1BCL2L1MEN1KMT2AALDH1A1
SCHEMBL7736938 0.76 ALDH1A1 (0.50) MCL1BCL2L1MEN1KMT2AALDH1A1
SCHEMBL1171779 0.74 ALDH1A1 (0.50) MCL1BCL2L1MEN1KMT2AALDH1A1
SCHEMBL28559284 0.73 CYP2C9 (0.32) MEN1KMT2AALDH1A1MAPT
SCHEMBL14596222 0.73 ALDH1A1 (0.37) MCL1BCL2L1MEN1KMT2AALDH1A1
SCHEMBL21609552 0.72 ALDH1A1 (0.46) MCL1BCL2L1MEN1KMT2AALDH1A1

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-112646589-B Liquid crystal compound and application thereof 晶美晟光电材料(南京)有限公司 2023-03-31 CN disclosed
CN-112707798-B Preparation method of liquid crystal compound containing citrus greening alcohol-based methoxy idene bridge connecting group 晶美晟光电材料(南京)有限公司 2023-03-28 CN disclosed