SCHEMBL697875

SCHEMBL697875

O=C(c1cccc(Br)c1C(F)F)c1nccn1Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.40
FDPS P14324 1/20 0.39
ADRA1D P25100 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 1/20 0.36
AGTR1 P30556 1/20 0.36
AGTR2 P50052 1/20 0.36
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL697936 0.87 RAB9A (0.39) RAB9ANPC1SMN1; SMN2ALDH1A1FDPS
SCHEMBL697274 0.83 RAB9A (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL30301958 0.78 RAB9A (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1FDPS
SCHEMBL24827313 0.78 RAB9A (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1FDPS
SCHEMBL697005 0.78 RAB9A (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL27753895 0.77 HSD17B10 (0.41) RAB9ANPC1SMN1; SMN2ALDH1A1FDPS
SCHEMBL699102 0.76 RAB9A (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL697921 0.75 RAB9A (0.51) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL30301935 0.75 RAB9A (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1FDPS
SCHEMBL24826220 0.75 RAB9A (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
CN-101370786-B Substituted imidazoles and their use as pesticides PFIZER 2012-01-11 CN disclosed
CN-101370786-A Substituted imidazoles and their use as pesticides PFIZER LTD (GB) 2009-02-18 CN disclosed