SCHEMBL6184828

SCHEMBL6184828

COC(=O)Oc1ccc2sc(N)nc2c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 4/20 0.42
MAPT P10636 2/20 0.40
PDPK1 O15530 1/20 0.39
KDM4E B2RXH2 3/20 0.37
UBE2N P61088 2/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
PKM P14618 1/20 0.36
DYRK1A Q13627 1/20 0.36
CYP1A2 P05177 3/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
GAA P10253 2/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL6184530 0.83 MAPT (0.46) ALDH1A1MAPTPOLBDYRK1ANPC1
SCHEMBL6477475 0.77 ALDH1A1 (0.45) CYP3A4TDP1ALDH1A1MAPTPDPK1
SCHEMBL6984764 0.74 KDM4E (0.36) TDP1ALDH1A1MAPTKDM4EPOLB
SCHEMBL7936559 0.71 PDPK1 (0.58) CYP3A4TDP1ALDH1A1MAPTPDPK1
SCHEMBL29754543 0.70 ALDH1A1 (0.61) CYP3A4TDP1ALDH1A1MAPTPDPK1
SCHEMBL6234853 0.70 ALDH1A1 (0.61) CYP3A4TDP1ALDH1A1MAPTPDPK1
SCHEMBL6979296 0.69 MAPT (0.46) TDP1ALDH1A1MAPTKDM4EDYRK1A
SCHEMBL27051775 0.69 CYP3A4 (0.59) CYP3A4TDP1ALDH1A1MAPTPDPK1
SCHEMBL6984168 0.69 ALDH1A1 (0.44) ALDH1A1MAPTKDM4EPOLBNPC1
SCHEMBL3050838 0.68 CYP3A4 (0.63) CYP3A4TDP1ALDH1A1MAPTPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1347969-B1 5- (PYRAZOL-4-YL)CARBONYL]BENZAZOLONE AS HERBICIDE BASF AG (DE) 2005-03-23 EP disclosed
EP-1347969-A1 5- (PYRAZOL-4-YL)CARBONYL]BENZAZOLONE AS HERBICIDE BASF AKTIENGESELLSCHAFT (DE) 2003-10-01 EP disclosed
EP-1177194-B1 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS BASF AG (DE) 2003-09-17 EP disclosed
EP-1341776-A1 BENZAZOLONYLCARBONYL CYCLOHEXENONES AND USE THEREOF AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2003-09-10 EP disclosed
WO-2002048121-A1 BENZAZOLONYLCARBONYL CYCLOHEXENONES AND USE THEREOF AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-06-20 WO disclosed
WO-2002048140-A1 5-[(PYRAZOL-4-YL)CARBONYL]BENZAZOLONE AS HERBICIDE BASF AKTIENGESELLSCHAFT (DE) 2002-06-20 WO disclosed
EP-1177194-A1 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS BASF AKTIENGESELLSCHAFT (DE) 2002-02-06 EP disclosed
WO-2000068228-A1 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS BASF AKTIENGESELLSCHAFT (DE) 2000-11-16 WO disclosed