SCHEMBL14909790

SCHEMBL14909790

O=CC(Cl)CCCCCCl

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 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
SCHEMBL7722179 1.00 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL7734117 1.00 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL7721808 1.00 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL7728715 0.97
SCHEMBL11458517 0.90
SCHEMBL9329136 0.78
SCHEMBL3035856 0.78 ADH1B (0.47) TSHR
SCHEMBL738270 0.78 ADH1B (0.47) TSHR
SCHEMBL5277050 0.78 ADH1B (0.47) TSHR
SCHEMBL5270880 0.78 ADH1B (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2589569-A1 METHOD FOR CONTROLLING HYDROTHERMAL SYNTHESIS REACTION USING ALDEHYDE Tohoku University (JP) 2013-05-08 EP disclosed