SCHEMBL8547866

SCHEMBL8547866

CC(C)c1ccc(CCCc2ncnc3ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.43
ACHE P22303 1/20 0.41
EGFR P00533 4/20 0.40
NR2F2 P24468 3/20 0.40
LMNA P02545 2/20 0.40
GALR3 O60755 2/20 0.40
APP P05067 1/20 0.40
MAPK1 P28482 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
MAPT P10636 1/20 0.39
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PIK3CD O00329 1/20 0.37
PIK3R1 P27986 1/20 0.37

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
SCHEMBL8545576 0.84 HTT (0.59) HTTACHEEGFRNR2F2LMNA
SCHEMBL8547170 0.83 HTT (0.55) HTTACHEEGFRNR2F2LMNA
SCHEMBL8547787 0.82 RAB9A (0.52) HTTEGFRNR2F2LMNAGALR3
SCHEMBL8543918 0.81 RAB9A (0.51) HTTLMNAMAPTALDH1A1L3MBTL1
SCHEMBL8544390 0.80 ACHE (0.43) HTTACHEEGFRNR2F2LMNA
SCHEMBL8547574 0.78 RAB9A (0.54) HTTEGFRNR2F2LMNAGALR3
SCHEMBL8547584 0.77 KDR (0.51) HTTACHEEGFRNR2F2LMNA
SCHEMBL29057185 0.77 SMN1; SMN2 (0.53) HTTACHEEGFRLMNAAPP
SCHEMBL5826355 0.74 RAB9A (0.57) HTTLMNAALDH1A1L3MBTL1RAB9A
SCHEMBL11953072 0.73 ALDH1A1 (0.48) HTTACHEEGFRNR2F2LMNA

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