Lawsone

Lawsone

SCHEMBL6849999

O=C1C=C(O)C(=O)c2ccccc21.O=C1C=C(O)C(=O)c2ccccc21.O=C1C=C(O)C(=O)c2ccccc21

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.68
MAPK1 P28482 5/20 0.68
KDM4E B2RXH2 4/20 0.68
ALDH1A1 P00352 3/20 0.68
CYP3A4 P08684 2/20 0.68
HPGD P15428 2/20 0.68
PTPN22 Q9Y2R2 1/20 0.68
KMT2A Q03164 6/20 0.56
MEN1 O00255 5/20 0.56
CDC25B P30305 3/20 0.56
BLM P54132 3/20 0.56
MAOA P21397 3/20 0.56
LMNA P02545 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
IDO1 P14902 2/20 0.56
CDC25A P30304 2/20 0.56
USP2 O75604 2/20 0.56
ATM Q13315 2/20 0.56
PLIN1 O60240 2/20 0.56
PLIN5 Q00G26 2/20 0.56

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
Lawsone SCHEMBL16541 1.00 MAPT (0.68) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL5826345 1.00 MAPT (0.68) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL29350263 1.00 MAPT (0.68) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL6052663 0.98 MAPT (0.65) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL6052709 0.98 MAPT (0.65) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL6052722 0.98 MAPT (0.65) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL9136705 0.96 MAPT (0.63) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL918203 0.94 MAPT (0.61) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL19742249 0.92 MAPT (0.59) MAPTMAPK1KDM4EALDH1A1CYP3A4
Lawsone SCHEMBL2720419 0.92 MAPT (0.59) MAPTMAPK1KDM4EALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423371-A1 TRIAZINE DERIVATIVES AND THEIR USE AS SUNSCREENS Ciba SC Holding AG (CH) 2004-06-02 EP disclosed
WO-2003016289-A1 TRIAZINE DERIVATIVES AND THEIR USE AS SUNSCREENS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-02-27 WO disclosed