SCHEMBL7652711

SCHEMBL7652711

COc1ccc(C(=O)C=CC2=COC(Cc3ccccc3)O2)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 6/20 0.60
MAPT P10636 4/20 0.60
LMNA P02545 3/20 0.60
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
RECQL P46063 1/20 0.60
ATM Q13315 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
APP P05067 9/20 0.60
MEN1 O00255 3/20 0.54
MAPK1 P28482 3/20 0.54
KMT2A Q03164 3/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C19 P33261 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MAOB P27338 2/20 0.50
CTSL P07711 1/20 0.50
ALDH1A1 P00352 1/20 0.49
TP53 P04637 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL7662659 0.92 MAPT (0.50) ABCG2MAPTLMNANPC1RAB9A
SCHEMBL7654658 0.83 APP (0.39) ABCG2MAPTLMNANPC1RAB9A
SCHEMBL7664550 0.81 MAPT (0.43) MAPTNPC1RAB9AATML3MBTL1
SCHEMBL7657631 0.81 CYP1A1 (0.43) ABCG2MAPTLMNANPC1RAB9A
SCHEMBL7652008 0.81 NR1H4 (0.47) ABCG2MAPTNPC1RAB9AAPP
SCHEMBL7664261 0.80 AR (0.39) ABCG2MAPTLMNANPC1RAB9A
SCHEMBL7656619 0.79 AURKA (0.48) ABCG2MAPTATMMEN1KMT2A
SCHEMBL7657806 0.78 AR (0.51) MAPTLMNARECQLL3MBTL1MEN1
SCHEMBL7666636 0.78 AR (0.58) MAPTLMNANPC1L3MBTL1MEN1
SCHEMBL7666145 0.78 MAOB (0.58) MAPTL3MBTL1CYP2C19MAOBALDH1A1

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-6500846-B1 2-(4-CHLOROPHENYL)-7-METHOXYCHROMEN-4-ONE, AS CYCLIN-DEPENDENT KINASE INHIBITORS, USED AS ANTICARCINOGENIC AGENTS OR FOR PROPHYLAXIS OF NEURODEGENERATIVE DISEASE LG CHEMICAL, LTD. (KR) 2002-12-31 US disclosed