SCHEMBL8368458

SCHEMBL8368458

OCCOc1cccc(O)c1OCCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
MAPT P10636 2/20 0.50
GAA P10253 2/20 0.50
JAK2 O60674 1/20 0.50
IDO1 P14902 1/20 0.50
HTR1A P08908 1/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46
ALDH1A1 P00352 2/20 0.42
RECQL P46063 1/20 0.42
TSHR P16473 3/20 0.42
CHRM2 P08172 2/20 0.42
ALOX15 P16050 2/20 0.42
CHRM1 P11229 1/20 0.42
ACHE P22303 1/20 0.42
KCNH2 Q12809 1/20 0.42
HIF1A Q16665 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL8897368 0.87 LMNA (0.52) LMNAMAPTGAAJAK2IDO1
SCHEMBL11808177 0.85 IDO1 (0.41) LMNAMAPTGAAJAK2IDO1
SCHEMBL3500769 0.83 LMNA (0.54) LMNAMAPTGAAJAK2IDO1
SCHEMBL1837129 0.82 LMNA (0.49) LMNAMAPTGAAJAK2HTR1A
SCHEMBL14060482 0.82 IDO1 (0.56) LMNAMAPTGAAJAK2IDO1
SCHEMBL1030614 0.81 GAA (0.75) LMNAMAPTGAAJAK2IDO1
SCHEMBL1838521 0.81 CYP1A2 (0.50) LMNAMAPTGAAJAK2HTR1A
Ammonia Solution, Strong SCHEMBL27537195 0.81 LMNA (0.47) LMNAMAPTGAAJAK2HTR1A
SCHEMBL1840614 0.79 LMNA (0.47) LMNAMAPTGAAJAK2HTR1A
SCHEMBL561025 0.79 LMNA (0.43) LMNAMAPTGAAJAK2HTR1A

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
WO-1999047578-A1 SURFACE ACTIVE POLYESTERS REICHHOLD, INC. (US) 1999-09-23 WO disclosed