Cyclopentane

Cyclopentane

SCHEMBL16054100

C1CCCC1.CCC(=O)OC

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
MGAM O43451 2/20 0.46
GAA P10253 2/20 0.46
SI P14410 2/20 0.46
MGAM2 Q2M2H8 2/20 0.46
HSD17B10 Q99714 1/20 0.46
FFAR3 O14843 1/20 0.42
EPHX2 P34913 3/20 0.41
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 2/20 0.38
LMNA P02545 2/20 0.38
TET2 Q6N021 1/20 0.37
MEN1 O00255 1/20 0.37
NAAA Q02083 1/20 0.36
CA12 O43570 1/20 0.36
CA14 Q9ULX7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
RECQL P46063 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL27583315 0.91 TSHR (0.59) TSHRMGAMGAASIMGAM2
SCHEMBL3288569 0.91
SCHEMBL15434 0.91
Propionic Acid SCHEMBL134040 0.88 FFAR3 (0.59) TSHRMGAMGAASIMGAM2
Ammonia Solution, Strong SCHEMBL116114 0.88
SCHEMBL5074662 0.88
SCHEMBL4653893 0.88
SCHEMBL4652748 0.88
SCHEMBL6445886 0.88 TSHR (0.56) TSHRMGAMGAASIMGAM2
Methoxymethane SCHEMBL7245196 0.88

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-2014141181-A1 PROCESS FOR PREPARING PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY NO 2 LIMITED (GB) 2014-09-18 WO disclosed