SCHEMBL8543530

SCHEMBL8543530

FC(F)(F)c1ccc(CCOc2ncnc3ccccc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
NPC1 O15118 2/20 0.54
TSHR P16473 2/20 0.54
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
CYP19A1 P11511 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
AKT1 P31749 1/20 0.42
AKT2 P31751 1/20 0.42
AKT3 Q9Y243 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
KDR P35968 2/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
BRAF P15056 1/20 0.41
MAPK14 Q16539 1/20 0.41

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
SCHEMBL8544690 0.88 RAB9A (0.52) RAB9AL3MBTL1NPC1TSHRLMNA
Fenazaquin SCHEMBL29429249 0.86 RAB9A (0.54) RAB9AL3MBTL1NPC1TSHRLMNA
Fenazaquin SCHEMBL26216 0.86 RAB9A (0.54) RAB9AL3MBTL1NPC1TSHRLMNA
SCHEMBL8546894 0.86 LMNA (0.64) RAB9AL3MBTL1NPC1TSHRLMNA
SCHEMBL8540665 0.86 TSHR (0.50) RAB9AL3MBTL1NPC1TSHRLMNA
SCHEMBL9384621 0.86 RAB9A (0.57) RAB9AL3MBTL1NPC1TSHRLMNA
Fenazaquin SCHEMBL27889647 0.85 RAB9A (0.52) RAB9AL3MBTL1NPC1TSHRLMNA
SCHEMBL9163687 0.84 RAB9A (0.55) RAB9AL3MBTL1NPC1TSHRLMNA
SCHEMBL8548739 0.84 RAB9A (0.69) RAB9AL3MBTL1NPC1TSHRLMNA
SCHEMBL8545631 0.84 MAPK14 (0.52) RAB9AL3MBTL1NPC1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0326329-B1 Quinazoline derivatives useful as insecticides. DOW AGROSCIENCES LLC (US) 1998-10-28 EP disclosed