SCHEMBL27337398

SCHEMBL27337398

c1ccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2cccc3ccccc23)c(-c2cc3c4ccccc4oc3c3ccccc23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 2/20 0.33
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
AHR P35869 1/20 0.32
PRKDC P78527 2/20 0.32
GGPS1 O95749 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL27337377 0.95 ALOX5 (0.42) ALOX5KDM4EALDH1A1HSD17B10ENPP3
SCHEMBL27336959 0.93 ALOX5 (0.41) ALOX5KDM4EALDH1A1HSD17B10GAA
SCHEMBL27337207 0.93 ALOX5 (0.41) ALOX5KDM4EALDH1A1HSD17B10GAA
SCHEMBL27337403 0.93 ALOX5 (0.40) ALOX5KDM4EALDH1A1HSD17B10ENPP3
SCHEMBL24825450 0.93 ALOX5 (0.42) ALOX5KDM4EALDH1A1HSD17B10ENPP3
SCHEMBL27337177 0.92 ALOX5 (0.40) ALOX5KDM4EALDH1A1HSD17B10ENPP3
SCHEMBL24965529 0.92 ALOX5 (0.43) ALOX5KDM4EALDH1A1HSD17B10ENPP3
SCHEMBL23232656 0.91 ALOX5 (0.42) ALOX5KDM4EALDH1A1HSD17B10ENPP3
SCHEMBL24825477 0.91 ALOX5 (0.41) ALOX5KDM4EALDH1A1HSD17B10ENPP3
SCHEMBL27046846 0.90 ALOX5 (0.46) ALOX5KDM4EALDH1A1HSD17B10ENPP3

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
WO-2023199832-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-10-19 WO disclosed