SCHEMBL9755918

SCHEMBL9755918

COc1ccccc1C(=O)NN(C(C)=O)C(C)(C)C

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.54
CTSD P07339 1/20 0.54
STAT3 P40763 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
KCNK3 O14649 1/20 0.49
KCNK9 Q9NPC2 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPK1 P28482 2/20 0.48
HPGD P15428 2/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
TP53 P04637 1/20 0.48
GLA P06280 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL9714501 0.88 ABCB1 (0.60) ABCB1CTSD
SCHEMBL9756349 0.86 CTSD (0.55) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9714386 0.85 POLB (0.67) ABCB1NPC1RAB9A
SCHEMBL9756392 0.83 ABCB1 (0.50) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756431 0.83 ABCB1 (0.50) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9755863 0.83 ABCB1 (0.50) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9755982 0.82 ABCB1 (0.55) ABCB1CTSDSTAT3
SCHEMBL9756010 0.82 CTSD (0.51) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756476 0.82 ABCB1 (0.49) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756276 0.82 ABCB1 (0.49) ABCB1CTSDSTAT3NPC1RAB9A

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-0234944-B1 INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-04-10 EP disclosed
EP-0232075-B1 INSECTICIDAL N'-SUBSTITUTED-N-ALKYLCARBONYL-N'-ACYL HYDRAZINES ROHM AND HAAS COMPANY (US) 1991-03-13 EP disclosed
EP-0234944-A1 Insecticidal N'-substituted-N-acyl-N'-alkylcarbonylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-02 EP disclosed