SCHEMBL18878637

SCHEMBL18878637

NC(Cc1cnc[nH]1)C(=O)NCCO

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NLN Q9BYT8 2/20 0.66
CYP3A4 P08684 1/20 0.61
SLC7A5 Q01650 1/20 0.61

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
SCHEMBL13585262 0.85 CYP3A4 (0.69) NLNCYP3A4SLC7A5
SCHEMBL13585259 0.85 CYP3A4 (0.69) NLNCYP3A4SLC7A5
SCHEMBL12259752 0.84 CYP3A4 (0.63) NLNCYP3A4SLC7A5
SCHEMBL19227330 0.84 CYP3A4 (0.63) NLNCYP3A4SLC7A5
SCHEMBL23652311 0.84 NLN (0.61) NLN
SCHEMBL24712703 0.84 NLN (0.61) NLN
SCHEMBL18862447 0.83 CYP3A4 (0.61) NLNCYP3A4SLC7A5
SCHEMBL27432299 0.83 CYP3A4 (0.66) NLNCYP3A4SLC7A5
SCHEMBL13944040 0.83 NLN (0.60) NLNCYP3A4SLC7A5
SCHEMBL13331622 0.82 CYP3A4 (0.69) NLNCYP3A4SLC7A5

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