SCHEMBL7359588

SCHEMBL7359588

N[C@H](CC1CCCCC1)[C@@H](OC(=O)C(F)(F)F)C(=O)NC(CF)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
CPB2 Q96IY4 12/20 0.38
GRN P28799 1/20 0.37
SORT1 Q99523 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
LTA4H P09960 1/20 0.37
MME P08473 1/20 0.36
ACE P12821 1/20 0.36
CPA1 P15085 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
SLC1A3 P43003 2/20 0.35
SLC1A2 P43004 2/20 0.35
SLC1A1 P43005 2/20 0.35
REN P00797 1/20 0.35

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
SCHEMBL7351879 0.86 LTA4H (0.47) METAP2METAP1CPB2CTSSCTSK
SCHEMBL6561648 0.81 CPB2 (0.38) METAP2METAP1CPB2GRNSORT1
SCHEMBL6486232 0.80 METAP2 (0.39) METAP2METAP1CPB2CTSSCTSK
SCHEMBL7357763 0.79 METAP2 (0.53) METAP2METAP1CPB2GRNSORT1
SCHEMBL7327231 0.78 REN (0.39) METAP2METAP1CTSSCTSKSLC1A3
SCHEMBL27822264 0.77 METAP2 (0.38) METAP2METAP1CPB2CTSSCTSK
SCHEMBL7350002 0.76 METAP2 (0.48) METAP2METAP1CPB2MMEACE
SCHEMBL29387045 0.72 GRN (0.52) CPB2GRNSORT1LTA4HMME
SCHEMBL9146938 0.71 LTA4H (0.50) CPB2GRNSORT1LTA4HMME
SCHEMBL9146946 0.71 LTA4H (0.50) CPB2GRNSORT1LTA4HMME

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-6242494-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS, DIABETIC RETINOPATHY, AND ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES 2001-06-05 US disclosed