SCHEMBL9111012

SCHEMBL9111012

C=C(C)C(=O)OCCOC(=O)C(=O)OCc1ccc(OC)cc1.COc1ccc(CO)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HTT P42858 2/20 0.42
POLB P06746 2/20 0.42
APEX1 P27695 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
FFAR1 O14842 1/20 0.42
MMP9 P14780 2/20 0.40
MMP1 P03956 1/20 0.40
F2RL1 P55085 1/20 0.40
MMP2 P08253 1/20 0.40
MMP12 P39900 1/20 0.40
THRB P10828 1/20 0.40
ATM Q13315 1/20 0.39
FABP7 O15540 1/20 0.39
FABP5 Q01469 1/20 0.39
P2RX4 Q99571 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
SCHEMBL8640696 0.94 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL8644721 0.89 HTT (0.53) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL453318 0.89 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL9111006 0.87 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL4354853 0.85 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2HTTPOLBAPEX1
SCHEMBL18432901 0.84 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL148322 0.83 SMN1; SMN2 (0.56) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL8642346 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL3758807 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL28028229 0.80 POLB (0.52) SMN1; SMN2MAPTNPC1RAB9AHTT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665961-A1 IMAGING MEDIUM AND PROCESS. POLAROID CORP (US) 1995-08-09 EP disclosed
EP-0665960-A1 IMAGING MEDIUM AND PROCESS POLAROID CORPORATION (US) 1995-08-09 EP disclosed
WO-1994010607-A1 IMAGING MEDIUM AND PROCESS POLAROID CORPORATION (US) 1994-05-11 WO disclosed
WO-1994010606-A1 IMAGING MEDIUM AND PROCESS POLAROID CORPORATION (US) 1994-05-11 WO disclosed