SCHEMBL18878676

SCHEMBL18878676

NC(=O)COCCOC(=O)C(N)Cc1cnc[nH]1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.56
▸ SLC7A5 Q01650 1/20 0.56
▸ NLN Q9BYT8 2/20 0.44

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
SCHEMBL18878730 0.87 CYP3A4 (0.56) CYP3A4SLC7A5
SCHEMBL28333429 0.86 CYP3A4 (0.57) CYP3A4SLC7A5NLN
SCHEMBL18804667 0.85 CYP3A4 (0.51) CYP3A4SLC7A5NLN
SCHEMBL18878681 0.85 CYP3A4 (0.51) CYP3A4SLC7A5NLN
SCHEMBL6436202 0.84 CYP3A4 (0.61) CYP3A4SLC7A5
SCHEMBL18878734 0.84 CYP3A4 (0.55) CYP3A4SLC7A5NLN
SCHEMBL18814097 0.83 CYP3A4 (0.49) CYP3A4SLC7A5
SCHEMBL18814527 0.83 CYP3A4 (0.48) CYP3A4SLC7A5NLN
SCHEMBL1668693 0.82 CYP3A4 (0.63) CYP3A4SLC7A5
SCHEMBL7739709 0.82 CYP3A4 (0.58) CYP3A4SLC7A5

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3170812-A1 IMIDAZOLE COMPOUND AND LIPOSOME CONTAINING SAME Fujifilm Corporation (JP) 2017-05-24 — — EP disclosed
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