SCHEMBL4780064

SCHEMBL4780064

O=C(Oc1ccc(F)cc1)N1CCC(F)CC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.56
ALDH1A1 P00352 1/20 0.56
POLB P06746 1/20 0.56
GAA P10253 1/20 0.54
RAB9A P51151 3/20 0.54
NPC1 O15118 2/20 0.54
FAAH O00519 4/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
MGLL Q99685 1/20 0.49
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
GPR119 Q8TDV5 1/20 0.47
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL8262856 0.87 GAA (0.72) ALOX15ALDH1A1POLBGAARAB9A
SCHEMBL4004500 0.84 LIPE (0.58) ALOX15ALDH1A1POLBGAARAB9A
SCHEMBL14389801 0.83 GAA (0.51) ALOX15ALDH1A1POLBGAARAB9A
SCHEMBL27795067 0.83 ALDH1A1 (0.82) ALOX15ALDH1A1POLBGAARAB9A
SCHEMBL14389786 0.81 GAA (0.49) ALOX15ALDH1A1POLBGAARAB9A
SCHEMBL10669648 0.81 ALOX15 (0.61) ALOX15GAARAB9ANPC1FAAH
SCHEMBL27627256 0.80 ALOX15 (0.56) ALOX15ALDH1A1POLBRAB9ANPC1
SCHEMBL5433602 0.80 ALOX15 (0.56) ALOX15ALDH1A1POLBGAARAB9A
SCHEMBL1243015 0.80 ALOX15 (0.47) ALOX15ALDH1A1POLBGAARAB9A
SCHEMBL8223160 0.79 ALOX15 (0.55) ALOX15ALDH1A1POLBGAARAB9A

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-2008012622-A2 AZABENZIMIDAZOLYL COMPOUNDS AS POTENTIATORS OF MGLUR2 SUBTYPE OF GLUTAMATE RECEPTOR PFIZER PRODUCTS INC. (US) 2008-01-31 WO disclosed