SCHEMBL28028154

SCHEMBL28028154

NC(=O)C(O)C(N)CCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 8/20 0.63
METAP1 P53582 4/20 0.63
ERAP1 Q9NZ08 4/20 0.50
ERAP2 Q6P179 3/20 0.50
ANPEP P15144 2/20 0.50
IL1RN P18510 2/20 0.45
GRIK1 P39086 1/20 0.44
CNR2 P34972 1/20 0.44
TRPA1 O75762 1/20 0.44
TSHR P16473 1/20 0.44
EPHX1 P07099 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
Hydrochloric Acid SCHEMBL3840035 0.98 METAP2 (0.61) METAP2METAP1ERAP1ERAP2ANPEP
SCHEMBL5848773 0.87 METAP2 (0.65) METAP2METAP1ERAP1ERAP2ANPEP
SCHEMBL21458090 0.87 METAP2 (0.65) METAP2METAP1ERAP1ERAP2ANPEP
SCHEMBL3841264 0.87 METAP2 (0.65) METAP2METAP1ERAP1ERAP2ANPEP
SCHEMBL5848452 0.87 METAP2 (0.65) METAP2METAP1ERAP1ERAP2ANPEP
Hydrochloric Acid SCHEMBL9369961 0.86 METAP2 (0.63) METAP2METAP1ERAP1ERAP2ANPEP
SCHEMBL6342154 0.81 SLC15A1 (0.56) ANPEPEPHX1
SCHEMBL10772763 0.81 SLC15A1 (0.56) ANPEPEPHX1
SCHEMBL289159 0.81 SLC15A1 (0.56) ANPEPEPHX1
SCHEMBL4619659 0.81 SLC15A1 (0.56) ANPEPEPHX1

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
CN-103282043-B Congenital agyria therapeutic agent OSAKA CITY UNIVERSITY (JP) 2015-09-30 CN disclosed