SCHEMBL4753360

SCHEMBL4753360

CCCCOc1ccc(C(F)(F)F)cc1N1CC[N]CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.46
PPARG P37231 4/20 0.41
PPARD Q03181 3/20 0.41
PPARA Q07869 3/20 0.41
LIPC P11150 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
NR1I2 O75469 1/20 0.40
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
ESR1 P03372 1/20 0.39
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PTGES O14684 1/20 0.36
ALOX5 P09917 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
SCHEMBL4750831 0.94 FFAR4 (0.40) PTGDR2PPARGPPARDPPARALIPC
SCHEMBL4751044 0.88 CYP1A2 (0.44) DRD2DRD3ALDH1A1SMN1; SMN2FFAR4
SCHEMBL4752820 0.81 FFAR4 (0.51) NR1I2ALDH1A1FFAR4KDM4E
SCHEMBL9579386 0.77 DRD2 (0.58) DRD2DRD3ALDH1A1L3MBTL1HSD17B10
SCHEMBL15473186 0.72 PTGDR2 (0.52) PTGDR2PPARGPPARDPPARAALDH1A1
SCHEMBL14029250 0.72 PTGDR2 (0.52) PTGDR2PPARGPPARDPPARAALDH1A1
SCHEMBL14028966 0.71 PTGDR2 (0.51) PTGDR2PPARGPPARDPPARAALDH1A1
SCHEMBL10352025 0.71 L3MBTL1 (0.62) PTGDR2PPARGPPARDPPARAALDH1A1
SCHEMBL17088080 0.70 ALDH1A1 (0.52) PTGDR2PPARGPPARDPPARANR1I2
SCHEMBL12968462 0.70 PPARD (0.53) PTGDR2PPARGPPARDPPARAALDH1A1

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
WO-2008146063-A1 NEW BENZOFURAN DERIVATIVES AS SELECTIVE 5HT6 RECEPTOR INHIBITORS AND PROCESS FOR THEIR PREPARATION EGIS GYÓGYSZERGYÁR Nyilvánosan Müködö Részvénytársagág (HU) 2008-12-04 WO disclosed