SCHEMBL4122426

SCHEMBL4122426

CCCCCOC(=O)c1cccc2c1-c1ccccc1C2=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.66
CYP3A4 P08684 3/20 0.66
MAPK1 P28482 3/20 0.66
TP53 P04637 1/20 0.66
ALDH1A1 P00352 6/20 0.64
LMNA P02545 2/20 0.64
TDP1 Q9NUW8 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
HSD17B10 Q99714 2/20 0.57
KDM4E B2RXH2 2/20 0.57
POLB P06746 1/20 0.57
KEAP1 Q14145 3/20 0.53
ELANE P08246 1/20 0.52
NFE2L2 Q16236 1/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50
CYP1A2 P05177 1/20 0.50
MAPT P10636 1/20 0.50
CYP2C9 P11712 1/20 0.50
ALOX15 P16050 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
SCHEMBL19327371 0.99 ALDH1A1 (0.67) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL4121227 0.99 ALDH1A1 (0.67) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL5154230 0.96 TSHR (0.65) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL28122618 0.95 TSHR (0.66) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL18022468 0.92 KEAP1 (0.55) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL18022467 0.92 KEAP1 (0.55) TSHRCYP3A4MAPK1TP53ALDH1A1
Anthraquinone SCHEMBL27653330 0.89 ALDH1A1 (0.82) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL13800968 0.84 MAPT (0.68) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL31670390 0.84 MAPT (0.68) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL8657075 0.83 KEAP1 (0.55) CYP3A4MAPK1TP53ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7479357-B2 Substituted 9H-fluorenone hydrazones SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-01-20 US disclosed
EP-1293837-B1 Electrophotographic organophotoreceptors SAMSUNG ELECTRONICS CO LTD (KR) 2008-10-08 EP disclosed
CN-1297855-C Organic photoreceptor of electronic photograph SAMSUNG ELECTRONICS CO LTD (KR) 2007-01-31 CN disclosed
CN-1276308-C Electrophotographic organic sensitization body with charge transfer compound SAMSUNG ELECTRONICS CO LTD (KR) 2006-09-20 CN disclosed
EP-1310483-B9 Electrophotographic organophotoreceptors with charge transport compounds SAMSUNG ELECTRONICS CO LTD (KR) 2006-07-05 EP disclosed
EP-1310483-B1 Electrophotographic organophotoreceptors with charge transport compounds SAMSUNG ELECTRONICS CO LTD (KR) 2006-02-22 EP disclosed
US-20050084784-A1 Electrophotographic organophotoreceptors with novel charge transport materials SAMSUNG ELECTRONICS CO., LTD. 2005-04-21 US disclosed
US-6696209-B2 SUCH AS BIS(FLUORENYL)-1,1'-(SULFONYLDI-4,1-PHENYLENE)BIS-HYDRAZONES; ELECTROPHOTOGRAPHY SAMSUNG ELECTRONICS CO. LTD. (KR) 2004-02-24 US disclosed
US-20030138712-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG ELECTRONICS CO. LTD. 2003-07-24 US disclosed
CN-1430105-A Electrophotographic organic sensitization body with charge transfer compound SAMSUNG ELECTRONICS CO LTD (KR) 2003-07-16 CN disclosed
US-20030104294-A1 Electrophotographic organophotoreceptors with novel charge transport materials SAMSUNG ELECTRONICS CO. LTD. 2003-06-05 US disclosed
EP-1310483-A1 Electrophotographic organophotoreceptors with charge transport compounds Samsung Electronics Co., Ltd. (KR) 2003-05-14 EP disclosed
CN-1416021-A Organic photoreceptor of electronic photograph SAMSUNG ELECTRONICS CO LTD (KR) 2003-05-07 CN disclosed
EP-1293837-A2 Electrophotographic organophotoreceptors Samsung Electronics Co., Ltd. (KR) 2003-03-19 EP disclosed