SCHEMBL7433916

SCHEMBL7433916

COP(=O)(OC)C(O)[C@H](CC1CCCCC1)NC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
REN P00797 9/20 0.36
LTA4H P09960 1/20 0.35
GRN P28799 1/20 0.35
SORT1 Q99523 1/20 0.35
CTSK P43235 3/20 0.35
CTSS P25774 2/20 0.35
METAP2 P50579 1/20 0.34
METAP1 P53582 1/20 0.34
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
MMP2 P08253 2/20 0.34
CA9 Q16790 2/20 0.34

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
SCHEMBL7435765 0.86 REN (0.41) RENMETAP2MMP2
SCHEMBL7432099 0.82 REN (0.38) RENLTA4HGRNSORT1CTSK
SCHEMBL7440606 0.81 REN (0.44) REN
SCHEMBL1862727 0.77 LTA4H (0.43) RENLTA4HGRNSORT1CTSK
SCHEMBL7268424 0.76 REN (0.41) RENLTA4HCTSKCTSSMETAP2
SCHEMBL7440602 0.75 REN (0.39) REN
SCHEMBL7429573 0.75 REN (0.50) RENCTSKCTSSCTSLCTSB
SCHEMBL7426913 0.74 CTSK (0.33) RENLTA4HGRNSORT1CTSK
SCHEMBL9226159 0.74 REN (0.45) RENLTA4HCTSK
SCHEMBL7280734 0.74 REN (0.45) RENLTA4HCTSK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5217958-A Hypotensive agents E. R. SQUIBB & SONS, INC. (US) 1993-06-08 US disclosed
EP-0331105-A2 1,2-Hydroxy phosphonates and derivatives thereof E.R. Squibb & Sons, Inc. (US) 1989-09-06 EP disclosed