SCHEMBL11283647

SCHEMBL11283647

CN(C)/C=C1/C(=O)N(c2ccccc2)C(=O)N1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.51
▸ GAA P10253 2/20 0.51
▸ RECQL P46063 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.45
▸ NOX4 Q9NPH5 3/20 0.42
▸ CYBB P04839 2/20 0.42
▸ NOX1 Q9Y5S8 1/20 0.42
▸ KMT2A Q03164 4/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MAPT P10636 3/20 0.39
▸ HTT P42858 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ NTSR1 P30989 1/20 0.39
▸ MGLL Q99685 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ USP2 O75604 2/20 0.37
▸ POLB P06746 1/20 0.37

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
SCHEMBL11283649 1.00 ALDH1A1 (0.51) ALDH1A1GAARECQLKDM4ENOX4
SCHEMBL11277684 0.87 ALDH1A1 (0.49) ALDH1A1GAARECQLKDM4ENOX4
SCHEMBL11277679 0.87 ALDH1A1 (0.49) ALDH1A1GAARECQLKDM4ENOX4
SCHEMBL28861966 0.75 ITGA4 (0.50) GAANOX4CYBBNOX1KMT2A
SCHEMBL2851080 0.74 MGLL (0.56) ALDH1A1GAAKMT2AMGLLMEN1
SCHEMBL11274061 0.72 ELANE (0.47) ALDH1A1GAARECQLKDM4ENOX4
SCHEMBL11274058 0.72 ELANE (0.47) ALDH1A1GAARECQLKDM4ENOX4
SCHEMBL7354909 0.71 ALDH1A1 (0.75) ALDH1A1GAARECQLKDM4EKMT2A
SCHEMBL11269789 0.71 NOX4 (0.51) ALDH1A1GAAKDM4ENOX4NOX1
SCHEMBL11275245 0.71 HSP90AA1 (0.46) ALDH1A1GAAKDM4ENOX4NOX1

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
US-4345935-A PREEMERGENT AND POSTEMERGENT APPLICATION ELI LILLY AND COMPANY (US) 1982-08-24 — — US disclosed
US-4345936-A Imidazoles, compositions and herbicidal method ELI LILLY AND COMPANY (US) 1982-08-24 — — US disclosed
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