SCHEMBL18878681

SCHEMBL18878681

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

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.51
▸ SLC7A5 Q01650 1/20 0.51
▸ NLN Q9BYT8 2/20 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
SCHEMBL18878676 0.85 CYP3A4 (0.56) CYP3A4SLC7A5NLN
SCHEMBL18804667 0.84 CYP3A4 (0.51) CYP3A4SLC7A5NLN
SCHEMBL18804666 0.83 HRH3 (0.46) CYP3A4SLC7A5
SCHEMBL18804665 0.83 HRH3 (0.46) CYP3A4SLC7A5
SCHEMBL18804668 0.83 HRH3 (0.46) CYP3A4SLC7A5
SCHEMBL18878730 0.83 CYP3A4 (0.56) CYP3A4SLC7A5
SCHEMBL18814097 0.82 CYP3A4 (0.49) CYP3A4SLC7A5
SCHEMBL28333429 0.82 CYP3A4 (0.57) CYP3A4SLC7A5NLN
SCHEMBL18804671 0.80 CYP3A4 (0.43) CYP3A4SLC7A5NLN
SCHEMBL18804713 0.80 CYP3A4 (0.43) CYP3A4SLC7A5NLN

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
EP-3170812-B1 IMIDAZOLE COMPOUND AND LIPOSOME CONTAINING SAME FUJIFILM CORP (JP) 2019-05-29 — — EP disclosed
EP-3170812-A1 IMIDAZOLE COMPOUND AND LIPOSOME CONTAINING SAME Fujifilm Corporation (JP) 2017-05-24 — — EP disclosed
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