SCHEMBL6561648

SCHEMBL6561648

CCC(NNC(=O)C(OC(=O)C(F)(F)F)[C@H](N)CC1CCCCC1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 9/20 0.38
REN P00797 1/20 0.38
METAP2 P50579 4/20 0.37
METAP1 P53582 2/20 0.37
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
LTA4H P09960 2/20 0.33
SLC1A3 P43003 2/20 0.33
SLC1A2 P43004 2/20 0.33
SLC1A1 P43005 2/20 0.33
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33

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
SCHEMBL7359588 0.81 METAP2 (0.39) CPB2RENMETAP2METAP1CTSS
SCHEMBL6486232 0.81 METAP2 (0.39) CPB2RENMETAP2METAP1CTSS
SCHEMBL7351879 0.81 LTA4H (0.47) CPB2RENMETAP2METAP1CTSS
SCHEMBL7327231 0.78 REN (0.39) RENMETAP2METAP1CTSSCTSK
SCHEMBL27822264 0.75 METAP2 (0.38) CPB2RENMETAP2METAP1CTSS
SCHEMBL7350002 0.70 METAP2 (0.48) CPB2RENMETAP2METAP1
SCHEMBL10767496 0.69 REN (0.42) RENMETAP2METAP1CTSSCTSK
SCHEMBL5709586 0.66 REN (0.44) RENMETAP2METAP1CTSK
SCHEMBL5709584 0.66 REN (0.41) RENMETAP2METAP1CTSK
SCHEMBL6565088 0.65 METAP2 (0.56) CPB2RENMETAP2METAP1

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
EP-1272456-B1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2004-10-27 EP claimed