SCHEMBL29645142

SCHEMBL29645142

CC(C)=CCC/C(C)=C\C[O]

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.68
ALOX15 P16050 3/20 0.62
MEN1 O00255 2/20 0.62
CYP3A4 P08684 2/20 0.62
ALDH1A1 P00352 3/20 0.60
MAPT P10636 2/20 0.60
UGT1A1 P22309 1/20 0.60
SQLE Q14534 4/20 0.58
KDM4E B2RXH2 2/20 0.56
ATM Q13315 1/20 0.56
POLB P06746 1/20 0.54
FNTA P49354 1/20 0.53
FNTB P49356 1/20 0.53

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
SCHEMBL532264 1.00 KMT2A (0.68) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL532263 1.00 KMT2A (0.68) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL2852929 0.98 KMT2A (0.73) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL1527772 0.98 KMT2A (0.73) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL2852926 0.98 KMT2A (0.73) KMT2AALOX15MEN1CYP3A4ALDH1A1
Acetaldehyde SCHEMBL27515440 0.93 KMT2A (0.60) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL7299167 0.83 KMT2A (0.73) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL7354471 0.83 KMT2A (0.73) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL23802597 0.81 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4ALDH1A1
Squalene SCHEMBL21823197 0.81 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4ALDH1A1

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-114466851-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2022-05-10 CN claimed
CN-114466851-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2022-05-10 CN disclosed
CN-114466851-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2022-05-10 CN disclosed