SCHEMBL8488964

SCHEMBL8488964

Fc1ccc([CH]c2cncc(Cl)c2)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.40
MAOA P21397 4/20 0.38
MAOB P27338 4/20 0.38
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
IDO1 P14902 1/20 0.32
TRPV3 Q8NET8 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NOX1 Q9Y5S8 1/20 0.30

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
SCHEMBL8485821 0.85 VCP (0.41) VCPMAOAMAOBCYP11B1CYP11B2
SCHEMBL7971923 0.74 CHRM5 (0.47) MAOAMAOB
SCHEMBL7968526 0.73 LMNA (0.40) CYP11B1CYP11B2NPC1RAB9A
SCHEMBL7968716 0.72 POLB (0.41) CYP11B1CYP11B2NPC1RAB9ATDP1
SCHEMBL8436212 0.72 CYP11B2 (0.39) MAOBCYP11B1CYP11B2
SCHEMBL7958255 0.71 NPC1 (0.40) NPC1RAB9A
SCHEMBL28825690 0.70 GRIN1 (0.42)
SCHEMBL28825631 0.69 ALDH1A1 (0.39) MAOBCYP11B1CYP11B2NPC1
SCHEMBL7958570 0.69 CYP11B2 (0.46) CYP11B1CYP11B2NPC1RAB9ATDP1
SCHEMBL28825579 0.69 NFE2L2 (0.46) CYP11B1CYP11B2NPC1RAB9A

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-1999055703-A1 2-ALKYL-3-(HETERO)ARYL-8-AZABICYCLO[3.2.1]ALKANES AS PESTICIDES ZENECA LIMITED (GB) 1999-11-04 WO disclosed