SCHEMBL16628203

SCHEMBL16628203

NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.63
▸ REN P00797 9/20 0.50
▸ ERAP2 Q6P179 1/20 0.43
▸ ERAP1 Q9NZ08 1/20 0.43
▸ LNPEP Q9UIQ6 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ SLC7A5 Q01650 1/20 0.43
▸ HRH1 P35367 1/20 0.42
▸ QRFPR Q96P65 1/20 0.41
▸ SCN9A Q15858 1/20 0.41
▸ SLC6A5 Q9Y345 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CPB2 Q96IY4 1/20 0.41

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
SCHEMBL27624890 0.84 SLC15A2 (0.61) SLC15A2RENERAP2ERAP1LNPEP
SCHEMBL29352785 0.83 SLC15A2 (0.92) SLC15A2RENCYP3A4SLC7A5SLC6A5
SCHEMBL23312951 0.82 SLC15A2 (0.61) SLC15A2RENCYP3A4SLC7A5SLC6A5
SCHEMBL19051549 0.82 SLC15A2 (0.56) SLC15A2RENCYP3A4SLC7A5HRH1
SCHEMBL12711228 0.81 REN (0.54) SLC15A2RENERAP2ERAP1LNPEP
SCHEMBL2197786 0.81 SLC15A2 (0.72) SLC15A2CYP3A4SLC7A5SLC6A5CA1
SCHEMBL30081493 0.81 SLC15A2 (0.72) SLC15A2CYP3A4SLC7A5SLC6A5CA1
SCHEMBL29379300 0.81 SLC15A2 (0.66) SLC15A2RENCYP3A4SLC7A5SLC6A5
SCHEMBL18862044 0.80 CYP3A4 (0.57) RENCYP3A4SLC7A5
SCHEMBL29271690 0.80 SLC15A2 (0.77) SLC15A2RENCYP3A4SLC7A5SLC6A5

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
WO-2015051052-A2 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2015-04-09 — — WO disclosed
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