SCHEMBL9009302

SCHEMBL9009302

CCC(CCCCCCCl)OC(CC)CCCCCCCl

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL9009391 1.00 TSHR (0.42) TSHRALDH1A1TDP1
SCHEMBL21173605 0.82 ALDH1A1 (0.35) TSHRALDH1A1TDP1
SCHEMBL10578824 0.81 TSHR (0.36) TSHRALDH1A1TDP1
SCHEMBL2848647 0.80 LMNA (0.42) TSHR
SCHEMBL9501255 0.80 LMNA (0.42) TSHR
SCHEMBL1931396 0.80 LMNA (0.42) TSHR
SCHEMBL10958705 0.80 LMNA (0.42) TSHR
SCHEMBL1068793 0.80 LMNA (0.42) TSHR
SCHEMBL1932427 0.80 LMNA (0.42) TSHR
SCHEMBL1931289 0.80 LMNA (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561441-B1 Process for the manufacture of epichlorohydrin SOLVAY (BE) 1996-11-06 EP disclosed
EP-0561441-A1 Process for the manufacture of epichlorohydrin SOLVAY (Société Anonyme) (BE) 1993-09-22 EP disclosed