SCHEMBL88459

SCHEMBL88459

O=C1c2ccccc2-c2ccc3c4ccc5c6c(ccc(c7ccc1c2c73)c64)C(=O)c1cccc(O)c1-5

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.53
MAPK1 P28482 5/20 0.53
MAOA P21397 4/20 0.53
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53
HSD17B10 Q99714 2/20 0.53
LMNA P02545 2/20 0.53
TSHR P16473 2/20 0.53
MAOB P27338 1/20 0.53
HTT P42858 1/20 0.53
CYP1A2 P05177 2/20 0.50
GNG2 P59768 1/20 0.50
GNB1 P62873 1/20 0.50
HIF1A Q16665 1/20 0.50
KDM4E B2RXH2 4/20 0.47
PABPC1 P11940 2/20 0.47
MEN1 O00255 5/20 0.47

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
SCHEMBL87593 0.91 MAOA (0.55) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL9491124 0.86 MAPT (0.63) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL9653065 0.83 MAPK1 (0.47) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL79475 0.83 BCL2 (0.60) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
Anthraquinone SCHEMBL4307959 0.83 BCL2 (0.60) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL29356917 0.83 BCL2 (0.60) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL12031457 0.83 BCL2 (0.60) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL12449237 0.83 BCL2 (0.60) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL88058 0.83 BCL2 (0.60) MAPTMAPK1MAOAALDH1A1SMN1; SMN2
SCHEMBL29354334 0.83 BCL2 (0.60) MAPTMAPK1MAOAALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2095131-B1 TAGGED PETROLEUM PRODUCTS AND METHODS OF DETECTING THE SAME AUTHENTIX INC (US) 2018-05-02 EP disclosed
CN-103804163-B A kind of preparation method of 16,17-bis-alkoxy violanthrone derivative BEIJING UNIVERSITY OF CHEMICAL TECHNOLOGY (CN) 2016-01-13 CN disclosed
CN-103804163-B A kind of preparation method of 16,17-bis-alkoxy violanthrone derivative BEIJING UNIVERSITY OF CHEMICAL TECHNOLOGY (CN) 2016-01-13 CN disclosed
CN-101606069-B Tagged petroleum products and methods of detecting the same AUTHENTIX INC 2014-12-03 CN disclosed
CN-103804163-A Method for preparing 16,17-dialkoxyviolanthrone derivatives UNIV BEIJING CHEMICAL 2014-05-21 CN disclosed
US-8129190-B2 Via violanthrone compounds APPLIED NANOTECH HOLDINGS, INC. (US) 2012-03-06 US disclosed
CN-101606069-A Tagged petroleum products and detection method thereof AUTHENTIX INC (US) 2009-12-16 CN disclosed
EP-2095131-A1 TAGGED PETROLEUM PRODUCTS AND METHODS OF DETECTING THE SAME Authentix, Inc. (US) 2009-09-02 EP disclosed
WO-2008063942-A1 TAGGED PETROLEUM PRODUCTS AND METHODS OF DETECTING THE SAME AUTHENTIX, INC. (US) 2008-05-29 WO disclosed
US-20080118982-A1 Tagged Petroleum Products and Methods of Detecting Same AUTHENTIX, INC. (US) 2008-05-22 US disclosed