SCHEMBL30198541

SCHEMBL30198541

NCCCC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERAP2 Q6P179 3/20 0.59
GHSR Q92847 4/20 0.57
ERAP1 Q9NZ08 2/20 0.53
LNPEP Q9UIQ6 2/20 0.53
ACE P12821 2/20 0.53
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
MPO P05164 1/20 0.51
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
KMT2A Q03164 1/20 0.51
HIF1A Q16665 1/20 0.51
NMBR P28336 1/20 0.51

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
SCHEMBL30403315 0.96 GHSR (0.62) ERAP2GHSR
SCHEMBL29407339 0.96 GHSR (0.62) ERAP2GHSR
SCHEMBL15391980 0.96 ERAP2 (0.62) ERAP2GHSRERAP1LNPEPACE
SCHEMBL16332701 0.96 ERAP2 (0.62) ERAP2GHSRERAP1LNPEPACE
SCHEMBL30866240 0.96 ERAP2 (0.59) ERAP2GHSRERAP1LNPEPACE
SCHEMBL29578372 0.94 GHSR (0.62) ERAP2GHSRERAP1LNPEPACE
SCHEMBL27702662 0.94 GHSR (0.62) ERAP2GHSRERAP1LNPEPACE
SCHEMBL3384748 0.94 GHSR (0.62) ERAP2GHSRERAP1LNPEPACE
SCHEMBL30465909 0.94 ERAP2 (0.70) ERAP2GHSRERAP1
SCHEMBL2946041 0.94 ERAP2 (0.59) ERAP2GHSRERAP1LNPEPACE

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
US-11566256-B2 Polynucleotides and polypeptides in plants MENDEL BIOTECHNOLOGY, INC. (US) 2023-01-31 US disclosed