SCHEMBL4455707

SCHEMBL4455707

N[C@@H](Cc1cnc[nH]1)C(=O)OC(=O)/C=C\C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.59
▸ SLC7A5 Q01650 1/20 0.59
▸ HRH4 Q9H3N8 2/20 0.43
▸ HRH3 Q9Y5N1 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ THPO P40225 1/20 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
SCHEMBL22462185 0.95 CYP3A4 (0.61) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL6779063 0.95 CYP3A4 (0.61) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL163444 0.85 CYP3A4 (0.71) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL1537285 0.85 CYP3A4 (0.71) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL29183811 0.84 CYP3A4 (0.58) CYP3A4SLC7A5HRH4HRH3MEN1
Hydrochloric Acid SCHEMBL28331180 0.83 CYP3A4 (0.69) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL28504890 0.83 CYP3A4 (0.57) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL28328192 0.82 CYP3A4 (0.67) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL5221763 0.81 CYP3A4 (0.65) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL27759486 0.81 CYP3A4 (0.65) CYP3A4SLC7A5HRH4HRH3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090017007-A1 LIQUID FACTOR VII COMPOSITION MAXYGEN HOLDINGS LTD. 2009-01-15 — — US claimed
EP-1919498-A2 LIQUID FACTOR VII COMPOSITION Maxygen Holdings Ltd. (KY) 2008-05-14 — — EP claimed
WO-2007022784-A2 LIQUID FACTOR VII COMPOSITION MAXYGEN HOLDINGS LTD. (KY) 2007-03-01 — — WO claimed
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