SCHEMBL11568628

SCHEMBL11568628

CC(C)COc1ccc(CC(=O)c2ccccc2)c(O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.47
MAPT P10636 3/20 0.47
HPGD P15428 3/20 0.47
POLB P06746 2/20 0.47
XBP1 P17861 1/20 0.47
FOS P01100 2/20 0.46
JUN P05412 2/20 0.46
NR1H4 Q96RI1 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
TP53 P04637 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
ALOX12 P18054 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL11566907 0.87 MAPK1 (0.51) POLBNR1H4L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL11566344 0.85 KMT2A (0.45) KAT6AMAPTHPGDPOLBL3MBTL1
SCHEMBL11565253 0.85 LMNA (0.50) KAT6AMAPTHPGDPOLBL3MBTL1
SCHEMBL6202473 0.82 POLB (0.61) MAPTHPGDPOLBL3MBTL1TP53
SCHEMBL11559415 0.81 GAA (0.54) MAPTHPGDPOLBL3MBTL1TP53
SCHEMBL24376194 0.78 HPGD (0.65) KAT6AMAPTHPGDPOLBXBP1
SCHEMBL29969473 0.78 HPGD (0.65) KAT6AMAPTHPGDPOLBXBP1
SCHEMBL15751641 0.77 KDM4E (0.51) MAPTL3MBTL1ALDH1A1LMNAKDM4E
SCHEMBL7533334 0.77 ALDH1A1 (0.54) ALDH1A1MEN1KMT2A
SCHEMBL11568624 0.76 MAOB (0.56) MAPTHPGDPOLBALDH1A1LMNA

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
US-4163746-A ANABOLIC, 5-METHYL-7-ALKOXYISOFLAVONES CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1979-08-07 US disclosed