SCHEMBL6470768

SCHEMBL6470768

CC(O)C(O)CO.CCC(O)CC(O)CO

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
USP2 O75604 1/20 0.31
CYP3A4 P08684 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL50575 0.85
SCHEMBL12863650 0.85
SCHEMBL6433072 0.83 LMNA (0.44) LMNAALDH1A1TDP1TSHRUSP2
Glycerin SCHEMBL27514435 0.80 LMNA (0.56) LMNAALDH1A1TDP1TSHRL3MBTL1
SCHEMBL7151383 0.78 LMNA (0.44) LMNAALDH1A1TDP1TSHRL3MBTL1
SCHEMBL7595607 0.78 LMNA (0.44) LMNAALDH1A1TDP1TSHRL3MBTL1
SCHEMBL5919483 0.78 LMNA (0.44) LMNAALDH1A1TDP1TSHRL3MBTL1
SCHEMBL7150167 0.78 LMNA (0.44) LMNAALDH1A1TDP1TSHRL3MBTL1
SCHEMBL15484295 0.78 TSHR (0.42) TSHR
SCHEMBL7151040 0.78 LMNA (0.44) LMNAALDH1A1TDP1TSHRL3MBTL1

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-20050136108-A1 Stepwise delivery of topiramate over prolonged period of time YAM NOYMI V (US) 2005-06-23 US disclosed