SCHEMBL9340405

SCHEMBL9340405

C=CC(=O)OC(C)OCCC1OCC(C)(C)CO1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31

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
SCHEMBL9336598 0.80 TSHR (0.42) TSHR
SCHEMBL9760131 0.78 TSHR (0.34) TSHR
SCHEMBL9336489 0.76 TSHR (0.53) TSHR
SCHEMBL3902375 0.74 TSHR (0.47) TSHR
SCHEMBL9759319 0.74
SCHEMBL9336568 0.73
SCHEMBL631546 0.72 SMN1; SMN2 (0.35) TSHR
SCHEMBL17213620 0.71 TSHR (0.47) TSHR
SCHEMBL13807552 0.71 ALDH1A1 (0.40) TSHR
SCHEMBL1144470 0.71 ALDH1A1 (0.41) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0283824-B1 Polysaccharide graft polymers containing acetal groups and their conversion to aldehyde groups NAT STARCH CHEM INVEST (US) 1994-06-08 EP claimed
US-5049634-A Derivatized and/or crosslinked products from acetal- and aldehyde-containing polysaccharide graft polymers NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1991-09-17 US claimed
US-4866151-A Polysaccharide graft polymers containing acetal groups and their conversion to aldehyde groups NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1989-09-12 US claimed
EP-0283824-A2 Polysaccharide graft polymers containing acetal groups and their conversion to aldehyde groups National Starch and Chemical Investment Holding Corporation (US) 1988-09-28 EP claimed
US-5049634-A Derivatized and/or crosslinked products from acetal- and aldehyde-containing polysaccharide graft polymers NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1991-09-17 US disclosed