SCHEMBL29093010

SCHEMBL29093010

CC(C)=CCOc1cc(O)cc2oc(-c3ccc(O)cc3)cc(=O)c12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.69
▸ KDM4E B2RXH2 3/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ TP53 P04637 2/20 0.56
▸ CYP3A4 P08684 2/20 0.56
▸ CYP2D6 P10635 2/20 0.56
▸ CYP2C9 P11712 2/20 0.56
▸ CYP2C19 P33261 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ POLH Q9Y253 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ FLT3 P36888 2/20 0.56
▸ MKNK2 Q9HBH9 2/20 0.56
▸ IP6K2 Q9UHH9 2/20 0.56
▸ GABRP O00591 1/20 0.56
▸ GABRD O14764 1/20 0.56
▸ RGS12 O14924 1/20 0.56
▸ NPC1 O15118 1/20 0.56

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
SCHEMBL30595011 1.00 PPARG (0.69) PPARGKDM4EMEN1ALDH1A1TP53
SCHEMBL2874033 0.80 POLH (0.79) KDM4EMEN1ALDH1A1TP53CYP3A4
SCHEMBL7072657 0.80 KMT2A (0.71) PPARGKDM4EMEN1ALDH1A1TP53
SCHEMBL3191617 0.78 PPARG (0.70) PPARGKDM4EMEN1ALDH1A1CYP3A4
SCHEMBL21236746 0.77 PPARG (0.80) PPARGKDM4EMEN1ALDH1A1TP53
SCHEMBL29494586 0.77 PPARG (0.80) PPARGKDM4EMEN1ALDH1A1TP53
SCHEMBL4839605 0.76 PLG (0.67) PPARGKDM4EMEN1ALDH1A1TP53
SCHEMBL19236007 0.76 XDH (0.72) KDM4EMEN1ALDH1A1TP53CYP3A4
SCHEMBL27772069 0.74 POLH (0.76) KDM4EMEN1ALDH1A1TP53CYP3A4
Apigenin SCHEMBL15475269 0.74 CYP1B1 (0.89) PPARGKDM4EMEN1ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116942656-A Application of naringenin derivative in preparation of anti-pancreatitis medicine 四川大学华西医院 2023-10-27 — — CN disclosed
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