SCHEMBL23027649

SCHEMBL23027649

c1ccc(-c2nc(-c3cccc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.50
GGPS1 O95749 1/20 0.41
MAPT P10636 5/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 2/20 0.40
PLA2G2A P14555 3/20 0.39
PLA2G4A P47712 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PRKDC P78527 3/20 0.38
PTGES2 Q9H7Z7 1/20 0.38
TSHR P16473 3/20 0.37
HPGD P15428 1/20 0.37
LMNA P02545 3/20 0.37
HSD17B10 Q99714 2/20 0.37
PIM1 P11309 1/20 0.37
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37

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
SCHEMBL23027647 1.00 ALOX5 (0.50) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027640 1.00 ALOX5 (0.50) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027471 1.00 ALOX5 (0.50) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027678 1.00 ALOX5 (0.50) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027685 0.99 ALOX5 (0.52) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027638 0.99 ALOX5 (0.52) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027645 0.99 ALOX5 (0.51) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027681 0.99 ALOX5 (0.51) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027654 0.99 ALOX5 (0.51) ALOX5GGPS1MAPTALDH1A1KDM4E
SCHEMBL23027644 0.97 ALOX5 (0.53) ALOX5GGPS1MAPTALDH1A1KDM4E

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-2021033731-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2021-02-25 WO disclosed