SCHEMBL21671010

SCHEMBL21671010

COOC(C)CCC(C)(C)OOC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL5580431 0.88 TSHR (0.35) TSHRTDP1
SCHEMBL397697 0.76 TSHR (0.40) TSHRTDP1
SCHEMBL9070171 0.76 TSHR (0.32) TSHRTDP1
SCHEMBL11657855 0.72 MAPK1 (0.39) TSHRTDP1
SCHEMBL14380151 0.71 TSHR (0.44) TSHRTDP1
SCHEMBL10688388 0.69 TSHR (0.57) TSHRTDP1
SCHEMBL23327 0.69 TSHR (0.57) TSHRTDP1
SCHEMBL2597607 0.69 TSHR (0.57) TSHRTDP1
SCHEMBL10642690 0.69 TSHR (0.33) TSHRTDP1
SCHEMBL11423803 0.69

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
EP-3604439-A1 RUBBER COMPOSITION AND CROSSLINKED RUBBER PRODUCT Zeon Corporation (JP) 2020-02-05 EP disclosed