SCHEMBL10754352

SCHEMBL10754352

CC(CCCCCOCC1CO1)CCCCCOCC1CO1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.67
ALDH1A1 P00352 4/20 0.65
TDP1 Q9NUW8 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.58
MAPK1 P28482 1/20 0.41
SPHK2 Q9NRA0 7/20 0.37
SPHK1 Q9NYA1 6/20 0.37
LMNA P02545 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
SCHEMBL22555764 0.96 TSHR (0.62) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL27475879 0.93 ALDH1A1 (0.77) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL8669169 0.93 ALDH1A1 (0.72) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL27472089 0.93 ALDH1A1 (0.77) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL24554552 0.91 ALDH1A1 (0.64) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL21795698 0.91 TSHR (0.60) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL21327579 0.89 TSHR (0.62) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL1402365 0.89 TSHR (0.62) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL9000977 0.89 TSHR (0.67) TSHRALDH1A1TDP1SMN1; SMN2MAPK1
SCHEMBL2670080 0.89 TSHR (0.67) TSHRALDH1A1TDP1SMN1; SMN2MAPK1

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
JP-62124114-A None JP disclosed
JP-S62124114-A EPOXY RESIN COMPOSITION MITSUI PETROCHEM IND LTD 1987-06-05 JP disclosed