SCHEMBL26313244

SCHEMBL26313244

C/C=C\c1c(C)c(-c2cccc3c2oc2cc4c(cc23)oc2ccccc24)c2ccccc2c1-c1ccc2ccccc2c1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.38
HDAC8 Q9BY41 1/20 0.33
PRKDC P78527 3/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
PTGES2 Q9H7Z7 1/20 0.31
MAOA P21397 1/20 0.31
GGPS1 O95749 1/20 0.31
PTGS2 P35354 1/20 0.30

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
SCHEMBL26311181 0.83 ALOX5 (0.40) ALOX5HDAC8PRKDCALDH1A1HPGD
SCHEMBL24663080 0.83 ALOX5 (0.48) ALOX5HDAC8PRKDCALDH1A1HPGD
SCHEMBL26311731 0.82 ALDH1A1 (0.33) ALDH1A1HPGDPTGS2
SCHEMBL23019050 0.82 ALDH1A1 (0.33) ALDH1A1HPGDPTGS2
SCHEMBL25636654 0.80 ALOX5 (0.36) ALOX5PRKDC
SCHEMBL17932068 0.80 ALOX5 (0.47) ALOX5HDAC8PRKDCALDH1A1HPGD
SCHEMBL24973904 0.79 ENPP3 (0.33) ALOX5PRKDCALDH1A1HPGDMAOA
SCHEMBL21710740 0.78 ALOX5 (0.36) ALOX5HDAC8PRKDCPTGES2GGPS1
SCHEMBL126383 0.78 ALOX5 (0.52) ALOX5HDAC8PRKDCPTGES2GGPS1
SCHEMBL22989927 0.78 ALOX5 (0.45) ALOX5HDAC8PRKDCALDH1A1HPGD

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
EP-4242196-A1 METHOD FOR PREPARING DEUTERATED ANTHRACENE COMPOUND, REACTION COMPOSITION, DEUTERATED ANTHRACENE COMPOUND AND COMPOSITION Lg Chem, Ltd. (KR) 2023-09-13 EP disclosed