SCHEMBL9492365

SCHEMBL9492365

C=CCOC(=O)C(Cc1ccccc1)NC(=O)CCCC

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.55
PSMB5 P28074 3/20 0.53
HDAC1 Q13547 4/20 0.51
HDAC6 Q9UBN7 4/20 0.51
POLB P06746 1/20 0.49
ALDH1A1 P00352 1/20 0.47
CTSB P07858 1/20 0.47
ACE P12821 1/20 0.47

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
SCHEMBL9492370 1.00 FAAH (0.55) FAAHPSMB5HDAC1HDAC6POLB
SCHEMBL9493900 0.96 FAAH (0.59) FAAHPSMB5HDAC1HDAC6
SCHEMBL9493898 0.96 FAAH (0.59) FAAHPSMB5HDAC1HDAC6
SCHEMBL9492999 0.93 PSMB5 (0.51) FAAHPSMB5HDAC1HDAC6POLB
SCHEMBL9493003 0.93 PSMB5 (0.51) FAAHPSMB5HDAC1HDAC6POLB
SCHEMBL9493066 0.88 ALDH1A1 (0.51) PSMB5POLBALDH1A1ACE
SCHEMBL9493061 0.88 ALDH1A1 (0.51) PSMB5POLBALDH1A1ACE
SCHEMBL9487001 0.85 HDAC1 (0.67) FAAHPSMB5HDAC1HDAC6POLB
SCHEMBL9486995 0.85 HDAC1 (0.67) FAAHPSMB5HDAC1HDAC6POLB
SCHEMBL9492286 0.83 MBTPS1 (0.50) POLBALDH1A1ACE

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
EP-0198397-B1 METHOD OF PRODUCING L-PHENYLALANINE KURARAY CO., LTD. (JP) 1993-01-07 EP disclosed
US-4743547-A PURITY, ENZYME HYDROLYSIS KURARAY CO., LTD. (JP) 1988-05-10 US disclosed
EP-0198397-A2 Method of producing L-phenylalanine KURARAY CO., LTD. (JP) 1986-10-22 EP disclosed