SCHEMBL9755863

SCHEMBL9755863

COc1ccccc1C(=O)NN(C(=O)C1CC1)C(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.50
CTSD P07339 1/20 0.49
TDP1 Q9NUW8 1/20 0.47
STAT3 P40763 1/20 0.47
FAAH O00519 1/20 0.46
CNR2 P34972 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 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
SCHEMBL9756078 0.96 ABCB1 (0.47) ABCB1CTSDTDP1STAT3FAAH
SCHEMBL9755927 0.96 MEN1 (0.48) ABCB1CTSDTDP1STAT3FAAH
SCHEMBL9755884 0.95 KMT2A (0.50) ABCB1CTSDTDP1STAT3
SCHEMBL9756356 0.95 KMT2A (0.50) ABCB1CTSDTDP1STAT3
SCHEMBL9755843 0.95 KMT2A (0.50) ABCB1CTSDTDP1STAT3
SCHEMBL9714501 0.83 ABCB1 (0.60) ABCB1CTSD
SCHEMBL9755918 0.83 ABCB1 (0.54) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756431 0.82 ABCB1 (0.50) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9756349 0.81 CTSD (0.55) ABCB1CTSDSTAT3NPC1RAB9A
SCHEMBL9755860 0.81 ABCB1 (0.49) 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 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