SCHEMBL2833285

SCHEMBL2833285

CC(CCCOCCOCCCC(C)C1CO1)C1CO1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SPHK2 Q9NRA0 1/20 0.30
SPHK1 Q9NYA1 1/20 0.30

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
SCHEMBL2830520 0.90 TSHR (0.34) TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL3382488 0.83 SMN1; SMN2 (0.31) TSHRSMN1; SMN2
SCHEMBL18418957 0.80 ALDH1A1 (0.31) ALDH1A1
SCHEMBL2833302 0.79 ALDH1A1 (0.31) ALDH1A1
SCHEMBL3378702 0.78 TSHR (0.34) TSHRSMN1; SMN2ALDH1A1TDP1SPHK2
SCHEMBL2833636 0.76 SMN1; SMN2 (0.37) TSHRSMN1; SMN2ALDH1A1TDP1SPHK2
SCHEMBL51692 0.76
SCHEMBL26189385 0.76 LMNA (0.40)
SCHEMBL2831088 0.75 SMN1; SMN2 (0.40) TSHRSMN1; SMN2ALDH1A1TDP1SPHK2
SCHEMBL2833759 0.75 SMN1; SMN2 (0.44) TSHRSMN1; SMN2ALDH1A1TDP1SPHK2

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
US-20100160555-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed