SCHEMBL11275245

SCHEMBL11275245

Cc1cccc(N2C(=O)/C(=C/N(C)C)N(C)C2=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.46
▸ MGLL Q99685 1/20 0.46
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ MAPT P10636 5/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ BCL2A1 Q16548 1/20 0.40
▸ CACNA1B Q00975 1/20 0.39
▸ APBA1 Q02410 1/20 0.39
▸ AMY1A P0DUB6 1/20 0.39
▸ USP2 O75604 2/20 0.39
▸ KEAP1 Q14145 2/20 0.39
▸ NFE2L2 Q16236 2/20 0.39
▸ NOX4 Q9NPH5 1/20 0.38
▸ NOX1 Q9Y5S8 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ HTT P42858 2/20 0.38

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
SCHEMBL11275254 1.00 HSP90AA1 (0.46) HSP90AA1MGLLL3MBTL1MEN1KMT2A
SCHEMBL11269789 0.86 NOX4 (0.51) HSP90AA1MGLLMEN1KMT2AGAA
SCHEMBL11269792 0.86 NOX4 (0.51) HSP90AA1MGLLMEN1KMT2AGAA
SCHEMBL11277684 0.84 ALDH1A1 (0.49) MEN1KMT2AGAAMAPTNOX4
SCHEMBL11277679 0.84 ALDH1A1 (0.49) MEN1KMT2AGAAMAPTNOX4
SCHEMBL11274061 0.82 ELANE (0.47) MGLLL3MBTL1MEN1KMT2AGAA
SCHEMBL11274058 0.82 ELANE (0.47) MGLLL3MBTL1MEN1KMT2AGAA
SCHEMBL11285401 0.82 AR (0.45) MEN1KMT2AGAAMAPTHSD17B10
SCHEMBL11285400 0.82 AR (0.45) MEN1KMT2AGAAMAPTHSD17B10
SCHEMBL11281434 0.81 SCN2A (0.51) MEN1KMT2AMAPTBCL2A1ALDH1A1

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