SCHEMBL9756431

SCHEMBL9756431

C#CC(=O)N(NC(=O)c1ccccc1OC)C(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.50
CTSD P07339 1/20 0.49
STAT3 P40763 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 2/20 0.46
KCNK3 O14649 1/20 0.45
KCNK9 Q9NPC2 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL9755959 0.85 ABCB1 (0.48) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9714501 0.83 ABCB1 (0.60) ABCB1CTSD
SCHEMBL9755918 0.83 ABCB1 (0.54) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756385 0.83 ABCB1 (0.47) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756223 0.83 CTSD (0.48) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9755863 0.82 ABCB1 (0.50) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756349 0.81 CTSD (0.55) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756141 0.81 CTSD (0.46) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9714386 0.80 POLB (0.67) ABCB1NPC1RAB9A
SCHEMBL9756059 0.79 ABCB1 (0.47) ABCB1

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-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