SCHEMBL19417656

SCHEMBL19417656

IC1CCC(OC[C@@H]2CO2)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 5/20 0.35
TDP1 Q9NUW8 2/20 0.34
TP53 P04637 2/20 0.33
CYP3A4 P08684 2/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
HIF1A Q16665 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
SCHEMBL733109 0.89 TSHR (0.50) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL14415206 0.82 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL14062955 0.82 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL7876608 0.79 TSHR (0.46) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL732071 0.79 TSHR (0.46) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL4408119 0.78 TSHR (0.41) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL285113 0.78 TSHR (0.41) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL9565285 0.78 TSHR (0.41) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL472962 0.77 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL3237384 0.77 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1TDP1TP53

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-3225612-B1 FLUOROPOLYETHER COMPOUND, LUBRICANT, MAGNETIC DISK, AND METHOD FOR PRODUCING SAME MORESCO CORP (JP) 2019-09-04 EP disclosed
EP-3225612-A1 FLUOROPOLYETHER COMPOUND, LUBRICANT, MAGNETIC DISK, AND METHOD FOR PRODUCING SAME Moresco Corporation (JP) 2017-10-04 EP disclosed