SCHEMBL30307288

SCHEMBL30307288

CCOc1ccc(C(=O)/C=C/c2cccc(OC)c2OC)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.70
MAOB P27338 5/20 0.67
KDM4E B2RXH2 2/20 0.67
LMNA P02545 2/20 0.67
MAPT P10636 2/20 0.67
ALDH1A1 P00352 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
NFE2L2 Q16236 3/20 0.61
KEAP1 Q14145 1/20 0.61
DPP4 P27487 2/20 0.60
ABCG2 Q9UNQ0 1/20 0.60
PTPN1 P18031 1/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
MAOA P21397 1/20 0.57
CYP1A1 P04798 1/20 0.56
CYP1B1 Q16678 1/20 0.56

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
SCHEMBL31676388 0.89 ALOX5 (0.78) ALOX5MAOBLMNAALDH1A1NFE2L2
SCHEMBL7186131 0.87 ALOX5 (0.65) ALOX5MAOBLMNAALDH1A1NFE2L2
SCHEMBL7185693 0.87 ALOX5 (0.65) ALOX5MAOBLMNAALDH1A1NFE2L2
SCHEMBL6357636 0.83 ALOX5 (0.78) ALOX5MAOBLMNAMAPTALDH1A1
SCHEMBL6357635 0.83 ALOX5 (0.78) ALOX5MAOBLMNAMAPTALDH1A1
SCHEMBL4026900 0.83 LMNA (0.78) ALOX5MAOBLMNAMAPTALDH1A1
SCHEMBL7102141 0.82 ALOX5 (0.76) ALOX5MAOBLMNAMAPTALDH1A1
SCHEMBL9342169 0.82 ALOX5 (0.68) ALOX5MAOBLMNAMAPTALDH1A1
SCHEMBL9342176 0.82 ALOX5 (0.68) ALOX5MAOBLMNAMAPTALDH1A1
SCHEMBL7190768 0.80 ABCG2 (0.82) MAOBKDM4ELMNAMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023034413-A2 METHODS AND AGENTS FOR MODULATING THE IMMUNE RESPONSE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-03-09 WO claimed
WO-2023034413-A2 METHODS AND AGENTS FOR MODULATING THE IMMUNE RESPONSE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-03-09 WO disclosed