SCHEMBL30117892

SCHEMBL30117892

COc1ccc(C(=O)Nc2ccccc2Cl)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.79
NPC1 O15118 3/20 0.69
RAB9A P51151 3/20 0.69
HDAC1 Q13547 3/20 0.68
HDAC8 Q9BY41 2/20 0.68
HDAC6 Q9UBN7 2/20 0.68
HDAC3 O15379 1/20 0.68
HDAC4 P56524 1/20 0.68
HDAC7 Q8WUI4 1/20 0.68
HDAC2 Q92769 1/20 0.68
HDAC10 Q969S8 1/20 0.68
HDAC11 Q96DB2 1/20 0.68
HDAC9 Q9UKV0 1/20 0.68
HDAC5 Q9UQL6 1/20 0.68
PDE4D Q08499 1/20 0.68
ALDH1A1 P00352 3/20 0.66
L3MBTL1 Q9Y468 2/20 0.66
GLA P06280 1/20 0.66
ATM Q13315 1/20 0.66
KMT2A Q03164 4/20 0.65

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
SCHEMBL3785860 1.00 F10 (0.79) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL3783197 0.87 F10 (0.68) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL3794444 0.86 F10 (0.76) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL3821744 0.85 F10 (0.93) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL13049170 0.84 RAB9A (0.65) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL5419665 0.84 F10 (0.74) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL7244178 0.84 F10 (0.73) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL5221640 0.83 F10 (0.81) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL8832040 0.83 F10 (0.81) F10NPC1RAB9AHDAC1HDAC8
SCHEMBL9620772 0.83 F10 (0.81) F10NPC1RAB9AHDAC1HDAC8

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
CN-112430216-B Preparation method of benzimidazole compound in pesticide 六夫丁作物保护有限公司 2022-12-09 CN disclosed