SCHEMBL87593

SCHEMBL87593

O=C1c2ccccc2-c2ccc3c4ccc5c6c(ccc(c7ccc1c2c37)c64)-c1cccc(O)c1C5=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.55
MAPT P10636 6/20 0.53
MAPK1 P28482 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
ALDH1A1 P00352 3/20 0.53
HPGD P15428 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
ALOX15 P16050 2/20 0.53
HSD17B10 Q99714 2/20 0.53
LMNA P02545 2/20 0.53
TSHR P16473 1/20 0.53
MAOB P27338 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
CYP1A2 P05177 2/20 0.50
GNG2 P59768 1/20 0.50
GNB1 P62873 1/20 0.50
HIF1A Q16665 1/20 0.50
TTR P02766 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
SCHEMBL88459 0.91 MAPT (0.53) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL9653065 0.89 MAPK1 (0.47) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL4705239 0.86 MAPT (0.68) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL1039833 0.83 MAOA (0.78) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
Anthraquinone SCHEMBL4307959 0.83 BCL2 (0.60) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL12449237 0.83 BCL2 (0.60) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL79475 0.83 BCL2 (0.60) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL88058 0.83 BCL2 (0.60) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL12031457 0.83 BCL2 (0.60) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL31253342 0.83 MAOA (0.78) MAOAMAPTMAPK1SMN1; SMN2ALDH1A1

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 5 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
US-8129190-B2 Via violanthrone compounds APPLIED NANOTECH HOLDINGS, INC. (US) 2012-03-06 US 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