SCHEMBL7974744

SCHEMBL7974744

O=C(NC1CCCCC1)c1cccc(Cl)n1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.64
HSD11B1 P28845 2/20 0.63
CNR1 P21554 4/20 0.55
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
ACKR3 P25106 1/20 0.54
KMT2A Q03164 2/20 0.53
GAA P10253 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
GRM5 P41594 2/20 0.51
MEN1 O00255 1/20 0.50

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
SCHEMBL7944353 0.92 CNR2 (0.54) CNR2HSD11B1CNR1NPC1RAB9A
SCHEMBL19445811 0.89 HSD11B1 (0.71) CNR2HSD11B1CNR1NPC1RAB9A
SCHEMBL31431912 0.83 HSD11B1 (0.64) CNR2HSD11B1CNR1NPC1RAB9A
SCHEMBL13267799 0.83 PRKAA2 (0.53) CNR2HSD11B1ACKR3KMT2A
SCHEMBL26412830 0.82 HSD11B1 (0.63) CNR2HSD11B1CNR1NPC1RAB9A
SCHEMBL22449358 0.82 ALDH1A1 (0.64) CNR2HSD11B1CNR1NPC1RAB9A
SCHEMBL2593387 0.82 HSD11B1 (0.63) CNR2HSD11B1CNR1NPC1RAB9A
SCHEMBL31432350 0.81 HSD11B1 (0.62) CNR2HSD11B1CNR1NPC1RAB9A
SCHEMBL8212053 0.81 PRKAA2 (0.51) CNR2HSD11B1ACKR3KMT2AGRM5
SCHEMBL24150310 0.80 HSD11B1 (0.60) CNR2HSD11B1CNR1NPC1RAB9A

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-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed