SCHEMBL696960

SCHEMBL696960

C=C(c1cccc(Br)c1C)c1nccn1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HSP90AA1 P07900 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
BRD4 O60885 1/20 0.37
NOTUM Q6P988 1/20 0.36
FDPS P14324 1/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL699209 0.88 RAB9A (0.46) RAB9ANPC1SMN1; SMN2HSD17B10TDP1
SCHEMBL705643 0.86 RAB9A (0.44) RAB9ANPC1SMN1; SMN2HSD17B10TDP1
SCHEMBL697274 0.86 RAB9A (0.49) RAB9ANPC1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL697594 0.85 RAB9A (0.46) RAB9ANPC1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL697825 0.84 RAB9A (0.42) RAB9ANPC1SMN1; SMN2HSD17B10TDP1
SCHEMBL27845582 0.84 ALDH1A1 (0.38) RAB9ANPC1SMN1; SMN2HSD17B10TDP1
SCHEMBL696695 0.83 RAB9A (0.42) RAB9ANPC1SMN1; SMN2HSD17B10TDP1
SCHEMBL697936 0.83 RAB9A (0.39) RAB9ANPC1SMN1; SMN2HSD17B10TDP1
SCHEMBL696521 0.82 RAB9A (0.45) RAB9ANPC1SMN1; SMN2HSD17B10TDP1
SCHEMBL698005 0.82 RAB9A (0.41) RAB9ANPC1SMN1; SMN2HSD17B10TDP1

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 2 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
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed