SCHEMBL6533899

SCHEMBL6533899

C=C(c1ccccc1)C(O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
XBP1 P17861 1/20 0.41
ATM Q13315 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
TSHR P16473 2/20 0.39
DAO P14920 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
AKT1 P31749 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
F2 P00734 1/20 0.36

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
SCHEMBL3731992 0.79 LMNA (0.48) LMNAMAPTXBP1ATMSMN1; SMN2
SCHEMBL4631540 0.77 LMNA (0.56) LMNASMN1; SMN2CES2CES1TSHR
SCHEMBL27317647 0.77 AKT1 (0.43) LMNAMAPTXBP1ATMSMN1; SMN2
SCHEMBL693987 0.76 SMN1; SMN2 (0.50) LMNAMAPTXBP1ATMSMN1; SMN2
SCHEMBL8840365 0.76 MAPT (0.40) LMNAMAPTXBP1ATMSMN1; SMN2
SCHEMBL7111247 0.75 MAOA (0.38) LMNAMAPTXBP1ATMSMN1; SMN2
SCHEMBL3005533 0.75 AKT1 (0.41) LMNAMAPTXBP1ATMSMN1; SMN2
Hydrogen Sulfide SCHEMBL29028321 0.74 SMN1; SMN2 (0.48) LMNAMAPTXBP1ATMSMN1; SMN2
SCHEMBL16062547 0.74 L3MBTL1 (0.54) LMNAMAPTXBP1ATMSMN1; SMN2
Ethylene Glycol SCHEMBL12990057 0.72 ALDH1A1 (0.37) LMNAMAPTXBP1ATMSMN1; SMN2

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-20050025729-A1 Lipstick BEIERSDORF AG 2005-02-03 US disclosed