SCHEMBL8013574

SCHEMBL8013574

C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)Nc1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 10/20 0.46
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
HTR1E P28566 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
S1PR3 Q99500 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
SCHEMBL9002757 0.97 TACR1 (0.44) TACR1OPRM1OPRD1OPRK1
SCHEMBL8017603 0.91 TACR1 (0.54) TACR1OPRM1OPRD1OPRK1
SCHEMBL9002892 0.86 CMA1 (0.50) TACR1
SCHEMBL8017209 0.85 MEN1 (0.43) TACR1OPRM1OPRD1OPRK1MEN1
SCHEMBL8010333 0.81 MMP3 (0.47) TACR1MEN1LMNAHTR1EHTT
SCHEMBL29941285 0.77 CYP2C9 (0.47) LMNAHTT
SCHEMBL25122378 0.76 CYP2C9 (0.47) MEN1HTTKMT2A
SCHEMBL25122278 0.76 CYP2C9 (0.47) MEN1HTTKMT2A
SCHEMBL23007438 0.76 CYP2C9 (0.47) MEN1HTTKMT2A
SCHEMBL25122224 0.76 CYP2C9 (0.47) MEN1HTTKMT2A

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-6127144-A PRODUCING HETEROLOGOUS PROTEINS BY INCUBATING STREPTOMYCES CELL TRANSFORMED WITH NUCLEIC ACID EXPRESSION CONSTRUCT IN PRESENCE OF PEPTIDE-SUSBSTITUTED CHLOROMETHYLKETONE AMINOPEPTIDASE INHIBITOR HAVING DEFINED STRUCTURE CANGENE CORPORATION (CA) 2000-10-03 US disclosed
EP-0731841-A1 PROTEASES FROM STREPTOMYCES AND USE THEREOF IN PROTEIN EXPRESSION SYSTEMS Cangene Corporation (CA) 1996-09-18 EP disclosed
WO-1995017512-A2 PROTEASES FROM STREPTOMYCES AND USE THEREOF IN PROTEIN EXPRESSION SYSTEMS CANGENE CORPORATION (CA) 1995-06-29 WO disclosed