SCHEMBL11208233

SCHEMBL11208233

CC(C)OOC(=O)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ELANE P08246 1/20 0.32

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
SCHEMBL11969862 0.97 TSHR (0.33) TSHRELANE
SCHEMBL11969238 0.88
SCHEMBL48511 0.81 ELANE (0.37) TSHRELANE
SCHEMBL4677241 0.80 TSHR (0.33) TSHR
SCHEMBL29045333 0.78 ELANE (0.36) TSHRELANE
SCHEMBL28185731 0.76 TSHR (0.31) TSHR
SCHEMBL28181178 0.76 TSHR (0.36) TSHR
SCHEMBL28185638 0.76 TSHR (0.36) TSHR
SCHEMBL1562931 0.75 TSHR (0.38) TSHR
Bicarbonate SCHEMBL29098229 0.75 TP53 (0.37) TSHRELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7528268-B2 Process for the preparation of lactones or epoxides FIRMENICH SA (CH) 2009-05-05 US disclosed
CN-1058781-A New heterocyclic anthracycline hydrocarbon homologue IAF BIOCHEM INT (CA) 1992-02-19 CN disclosed
US-4405747-A CONTAINING WAXY, OILY, OR FATTY SOLID AND HYDROLYZED POLYVINYL ALCOHOL HOECHST AKTIENGESELLSCHAFT (DE) 1983-09-20 US disclosed
US-4277592-A SOLUTION POLYMERIZATION IN ALIPHATIC HYDROCARBON USING TWO TYPES OF CATALYST, ONE OF WHICH IS SOLUBLE AND ONE OF WHICH IS INSOLUBLE HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-07 US disclosed