SCHEMBL13679355

SCHEMBL13679355

C=CCCC(CCC)OC

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 1/20 0.39
PLA2G2C Q5R387 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
SCHEMBL13456845 0.84
SCHEMBL20220546 0.84 TSHR (0.50) TSHRALDH1A1PLA2G2C
SCHEMBL1455036 0.82 TSHR (0.31) TSHR
SCHEMBL14137876 0.80 TSHR (0.40) TSHRALDH1A1PLA2G2C
SCHEMBL4486364 0.80
SCHEMBL4349371 0.79
SCHEMBL1454157 0.79
SCHEMBL386978 0.77
SCHEMBL2110564 0.75 TSHR (0.31) TSHR
SCHEMBL18533162 0.74 TSHR (0.42) TSHRALDH1A1

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-2103619-A1 IMIDAZOTHIAZOLE DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-09-23 EP disclosed