SCHEMBL7987678

SCHEMBL7987678

C=CCCCCN(C)C(=O)C(N)COCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.38
TACR1 P25103 2/20 0.36
MAOB P27338 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
FAAH O00519 1/20 0.36
MAPT P10636 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
SCHEMBL7987674 1.00 SLC1A1 (0.43) SLC1A1L3MBTL1TACR1MAOBNPSR1
SCHEMBL7975785 0.82 MAOB (0.47) MAOB
SCHEMBL7975789 0.82 MAOB (0.47) MAOB
SCHEMBL7992991 0.79 PPARA (0.57) L3MBTL1
SCHEMBL7986441 0.79 METAP2 (0.41) TACR1FAAH
SCHEMBL7986448 0.79 METAP2 (0.41) TACR1FAAH
SCHEMBL19138471 0.77 SLC1A1 (0.56) SLC1A1TACR1MAOB
SCHEMBL19138469 0.77 SLC1A1 (0.56) SLC1A1TACR1MAOB
SCHEMBL7989516 0.77 MMP3 (0.42)
SCHEMBL7987529 0.77 MMP3 (0.42)

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
WO-2001040198-A2 MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS AVENTIS PHARMA S.A. (FR) 2001-06-07 WO disclosed