SCHEMBL4356569

SCHEMBL4356569

C#CCCC#C.O=C1COC(=O)CO1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL9439689 0.76 TSHR (0.47) ALDH1A1LMNATP53TSHR
SCHEMBL13324558 0.76 TSHR (0.47) ALDH1A1LMNATP53TSHR
SCHEMBL15066 0.76
SCHEMBL20278839 0.76 TSHR (0.47) ALDH1A1LMNATP53TSHR
SCHEMBL8832603 0.76 TSHR (0.47) ALDH1A1LMNATP53TSHR
SCHEMBL14717601 0.73
SCHEMBL8984959 0.73
SCHEMBL8984924 0.73
SCHEMBL15385183 0.71 TSHR (0.37) ALDH1A1LMNATP53TSHR
Cyclopropane SCHEMBL17923269 0.70 ALDH1A1 (0.41) ALDH1A1LMNATP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927682-B2 Functionalization of polyglycolides by “click” chemistry BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2015-01-06 US disclosed
WO-2009029242-A1 FUNCTIONALIZATION OF POLYGLYCOLIDES BY 'CLICK' CHEMISTRY MICHIGAN STATE UNIVERSITY (US) 2009-03-05 WO disclosed
US-20090054619-A1 Functionalization of polyglycolides by \"click\" chemistry BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2009-02-26 US disclosed