SCHEMBL11575487

SCHEMBL11575487

CC(C)CC(NC(=O)CN)C(=O)N(CC(=O)O)C(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSB P07858 5/20 0.39
CTSL P07711 5/20 0.39
CTSS P25774 4/20 0.39
CTSK P43235 4/20 0.39
ACE P12821 1/20 0.39
FOLH1 Q04609 1/20 0.37
F2 P00734 1/20 0.37
F3 P13726 1/20 0.37
HPGDS O60760 1/20 0.37
NTSR1 P30989 1/20 0.37
LTA4H P09960 1/20 0.36
BCL2L1 Q07817 1/20 0.36

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
SCHEMBL28547713 0.78 ACE (0.49) ACELTA4H
SCHEMBL5915244 0.76 PSMB5 (0.45) ACE
SCHEMBL1623850 0.75 PLAU (0.41) F2F3
SCHEMBL3880587 0.74 REN (0.39) ACE
SCHEMBL28787568 0.73 KDM4E (0.42) CTSBCTSLCTSSCTSK
SCHEMBL11026921 0.73 ALDH1A1 (0.40)
SCHEMBL10505327 0.73 ALDH1A1 (0.40)
SCHEMBL16198357 0.71 LARS1 (0.42) CTSBCTSLCTSSCTSKACE
SCHEMBL16501164 0.69 LTA4H (0.55) ACELTA4H
SCHEMBL10594093 0.69 TAS1R3 (0.45) CTSBCTSLCTSSCTSK

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-4086136-A Process for producing a peptide using a serine or thiol proteinase (ZAIDANHOJIN) SAGAMI CHEMICAL RESEARCH CENTER (JA) 1978-04-25 US disclosed