SCHEMBL11374041

SCHEMBL11374041

COc1ccc(C(NC(Cc2ccccc2)C(=O)O)(OC)OC)c(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ KMT2A Q03164 2/20 0.43
▸ CTSG P08311 1/20 0.42
▸ CMA1 P23946 1/20 0.42
▸ ITGA4 P13612 1/20 0.42
▸ ITGB7 P26010 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ ECE1 P42892 1/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ POLB P06746 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
SCHEMBL11374027 1.00 FPR2 (0.47) FPR2ALDH1A1ALOX15GAAKMT2A
SCHEMBL11374378 0.83 ATM (0.44) ALDH1A1
SCHEMBL11374361 0.83 ATM (0.44) ALDH1A1
SCHEMBL11371629 0.79 KDM4E (0.39) ALDH1A1GAAKMT2APKM
SCHEMBL11371612 0.79 KDM4E (0.39) ALDH1A1GAAKMT2APKM
SCHEMBL11374993 0.77 MAPK1 (0.40) ALDH1A1GAAKMT2ANPSR1
SCHEMBL11375003 0.77 MAPK1 (0.40) ALDH1A1GAAKMT2ANPSR1
SCHEMBL11376027 0.73 KDM4E (0.43) ALDH1A1GAAKMT2APKMPOLB
SCHEMBL28650934 0.70 KMT2A (0.53) FPR2ALDH1A1ALOX15GAAKMT2A
SCHEMBL9223334 0.69 NPSR1 (0.55) ALDH1A1KMT2ANPSR1

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-4267344-A 3-PENTA/ALKOXY/BENZYL-; -XANTHYL-, -THIOXANTHYL-, OR -SELENOXANTHYLOXAZOLIDINE-2,5-DIONES PROTEINKEMISK INSTITUT. TILKNYTTET AKADEMIET FOR DE TEKNISKE VIDENSKABER (DK) 1981-05-12 — — US disclosed
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