SCHEMBL9755884

SCHEMBL9755884

COc1ccccc1C(=O)NN(C(=O)C1CCCCCCC1)C(C)(C)C

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
ABCB1 P08183 1/20 0.47
CTSD P07339 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
STAT3 P40763 1/20 0.43

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
SCHEMBL9756356 1.00 KMT2A (0.50) KMT2AMEN1SMN1; SMN2ABCB1CTSD
SCHEMBL9755843 1.00 KMT2A (0.50) KMT2AMEN1SMN1; SMN2ABCB1CTSD
SCHEMBL9755927 0.99 MEN1 (0.48) KMT2AMEN1SMN1; SMN2ABCB1CTSD
SCHEMBL9756078 0.96 ABCB1 (0.47) KMT2AMEN1ABCB1CTSDTDP1
SCHEMBL9755863 0.95 ABCB1 (0.50) ABCB1CTSDTDP1STAT3
SCHEMBL9756355 0.81 SMN1; SMN2 (0.53) KMT2AMEN1SMN1; SMN2ABCB1
SCHEMBL9755879 0.81 SMN1; SMN2 (0.53) KMT2AMEN1SMN1; SMN2ABCB1
SCHEMBL9755842 0.81 SMN1; SMN2 (0.53) KMT2AMEN1SMN1; SMN2ABCB1
SCHEMBL8166805 0.80 POLB (0.60)
SCHEMBL9755972 0.80 POLB (0.60)

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