SCHEMBL7716683

SCHEMBL7716683

O=C(OC1CC2C=CC1O2)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.47
LGALS9 O00182 2/20 0.43
LGALS1 P09382 2/20 0.43
LGALS3 P17931 2/20 0.43
LGALS7; LGALS7B P47929 2/20 0.43
LGALS8 O00214 1/20 0.43
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
NR4A1 P22736 1/20 0.40
NR4A2 P43354 1/20 0.40
NR4A3 Q92570 1/20 0.40
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MMP3 P08254 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
CDC25B P30305 2/20 0.36
HPGD P15428 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HRH3 Q9Y5N1 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
SCHEMBL7710799 0.78 LGALS9 (0.54) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL2899404 0.74 BCHE (0.46) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL7716646 0.73 LGALS9 (0.49) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL24278621 0.72 BCHE (0.46) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL9542149 0.71 KMT2A (0.55) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL27499333 0.69 KMT2A (0.53) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL2117154 0.69 KMT2A (0.53) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL27053487 0.69 LGALS9 (0.47) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL24278558 0.69 LGALS9 (0.47) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B
SCHEMBL28015205 0.68 BCHE (0.46) BCHELGALS9LGALS1LGALS3LGALS7; LGALS7B

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-6372854-B1 POLYALKENAMERS USED AS PHOTORESISTS HAVING EXCELLENT OPTICAL ELECTRICAL PROPERTIES; HIGH RIGIDITY; HEAT RESISTANCE; ADHESION AND WEAR RESISTANCE; HYDROGENATION; ACIDOLYSIS MITSUI CHEMICALS, INC. (JP) 2002-04-16 US disclosed