SCHEMBL11565248

SCHEMBL11565248

CCOc1ccc(C(=O)Cc2ccccc2)c(O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.62
MEN1 O00255 3/20 0.62
ALDH1A1 P00352 3/20 0.62
KMT2A Q03164 3/20 0.62
HSD17B10 Q99714 2/20 0.62
POLB P06746 1/20 0.62
BLM P54132 1/20 0.62
MAOB P27338 4/20 0.59
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
CYP3A4 P08684 1/20 0.58
ATM Q13315 1/20 0.58
ESR1 P03372 1/20 0.53
SHBG P04278 1/20 0.53
ESR2 Q92731 1/20 0.53
ALOX5 P09917 1/20 0.51
KDM4E B2RXH2 2/20 0.50
MAPT P10636 2/20 0.50
KLKB1 P03952 1/20 0.50

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
SCHEMBL11555374 0.89 MAOB (0.57) HPGDMEN1ALDH1A1KMT2AHSD17B10
SCHEMBL3811329 0.88 MAOB (0.71) HPGDMEN1ALDH1A1KMT2AMAOB
SCHEMBL29586539 0.85 NPC1 (0.74) HPGDMEN1ALDH1A1KMT2AMAOB
SCHEMBL3811897 0.85 NPC1 (0.74) HPGDMEN1ALDH1A1KMT2AMAOB
SCHEMBL11568624 0.85 MAOB (0.56) HPGDMEN1ALDH1A1KMT2AHSD17B10
SCHEMBL8983990 0.84 MAOB (0.55) HPGDMEN1ALDH1A1KMT2AMAOB
SCHEMBL11559411 0.84 MAOB (0.55) HPGDMEN1ALDH1A1KMT2AMAOB
SCHEMBL3813064 0.84 NPC1 (0.71) HPGDMEN1ALDH1A1KMT2APOLB
SCHEMBL29586008 0.83 NPC1 (0.58) HPGDMEN1ALDH1A1KMT2APOLB
SCHEMBL8983936 0.83 NPC1 (0.58) HPGDMEN1ALDH1A1KMT2APOLB

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