SCHEMBL28021384

SCHEMBL28021384

COc1c(Br)ccc2c1C(=O)c1ccc(Br)c(OC)c1C2=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
NPC1 O15118 2/20 0.53
MAPT P10636 7/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
EPHX2 P34913 2/20 0.40
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
USP2 O75604 1/20 0.39
DUSP3 P51452 1/20 0.39
TDP2 O95551 1/20 0.39
NSD2 O96028 1/20 0.39
HSP90AA1 P07900 1/20 0.39
PAX8 Q06710 1/20 0.39
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
LCK P06239 1/20 0.37
GLA P06280 1/20 0.37

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
SCHEMBL24165078 0.77 RAB9A (0.37) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL127769 0.74 CA2 (0.55) SMN1; SMN2MAPTALDH1A1KDM4EALOX5AP
SCHEMBL16108402 0.72 CES1 (0.45) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL30498292 0.72 CES1 (0.45) RAB9ASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL4306584 0.71 MAPT (0.37) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL8155703 0.71 RAB9A (0.49) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL1426442 0.69 SMN1; SMN2 (0.70) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL3419749 0.69 SMN1; SMN2 (0.70) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL496978 0.69 RAB9A (1.00) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL29906115 0.69 SMN1; SMN2 (0.70) RAB9ASMN1; SMN2NPC1MAPTMEN1

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-103159920-B Anthraquinonyl multipolymer solar cell material and its preparation method and application Haiyangwang Lighting Technology Co., Ltd. (CN) 2015-11-25 CN disclosed