SCHEMBL9756010

SCHEMBL9756010

CCCC(=O)N(NC(=O)c1ccccc1OC)C(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.51
ABCB1 P08183 1/20 0.49
MAPT P10636 2/20 0.47
TP53 P04637 2/20 0.47
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
HPGD P15428 2/20 0.46
GLA P06280 1/20 0.46
LMNA P02545 1/20 0.46
STAT3 P40763 1/20 0.46

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
SCHEMBL9756462 0.93 CTSD (0.49) CTSDABCB1MAPTTP53NPC1
SCHEMBL9756329 0.91 CTSD (0.48) CTSDABCB1MAPTTP53NPC1
SCHEMBL9756349 0.91 CTSD (0.55) CTSDABCB1MAPTTP53NPC1
SCHEMBL9756028 0.90 CTSD (0.47) CTSDABCB1MAPTMAPK1SMN1; SMN2
SCHEMBL9756127 0.90 CTSD (0.47) CTSDABCB1MAPTMAPK1SMN1; SMN2
SCHEMBL9756089 0.90 CTSD (0.47) CTSDABCB1MAPTMAPK1SMN1; SMN2
SCHEMBL9755948 0.90 CTSD (0.47) CTSDABCB1MAPTMAPK1SMN1; SMN2
SCHEMBL9756193 0.90 CTSD (0.47) CTSDABCB1MAPTMAPK1SMN1; SMN2
SCHEMBL9755900 0.86 TP53 (0.52) CTSDABCB1TP53NPC1RAB9A
SCHEMBL9755905 0.86 CTSD (0.43) CTSDABCB1MAPTTP53NPC1

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