SCHEMBL11060087

SCHEMBL11060087

COC(=O)OCC(I)=C(I)I

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 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
SCHEMBL11059461 0.82 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL11059458 0.82 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL11055977 0.80 TSHR (0.36) TSHR
SCHEMBL11053953 0.79 ALDH1A1 (0.59) ALDH1A1TSHR
SCHEMBL11052954 0.79 TSHR (0.36) ALDH1A1TSHR
SCHEMBL11050294 0.79 TSHR (0.39) SMN1; SMN2ALDH1A1TSHR
SCHEMBL11061767 0.76 NPC1 (0.34) SMN1; SMN2ALDH1A1
SCHEMBL11057577 0.76 ALDH1A1 (0.37) ALDH1A1TSHR
SCHEMBL8439630 0.75 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1TSHR
SCHEMBL11053030 0.73

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
US-4487781-A HEAT RESISTANCE; PHOTOSTABILITY SANKYO COMPANY LIMITED (JP) 1984-12-11 US disclosed