SCHEMBL25458069

SCHEMBL25458069

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5ccc6sc7cccc(-c8ccccc8)c7c6c5)c5oc6ccccc6c45)c3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.37
CDC14B O60729 2/20 0.36
CDC14A Q9UNH5 2/20 0.36
MAPT P10636 5/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
POLB P06746 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LIMK1 P53667 1/20 0.33
TSHR P16473 3/20 0.32
LMNA P02545 3/20 0.32
HSD17B10 Q99714 2/20 0.32
PIM1 P11309 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
MAPK1 P28482 1/20 0.32
HPGD P15428 1/20 0.32
BRDT Q58F21 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
SCHEMBL23823786 0.94 PIM3 (0.35) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL25458126 0.94 ALOX5 (0.38) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL23824008 0.93 ALOX5 (0.38) ALOX5MAPTALDH1A1KDM4EPOLB
SCHEMBL23821607 0.93 ALOX5 (0.37) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL25458121 0.92 CDC14B (0.36) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL22375985 0.92 CDC14B (0.36) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL22376928 0.92 CDC14B (0.36) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL25458059 0.92 ALOX5 (0.37) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL22375987 0.92 CDC14B (0.36) ALOX5CDC14BCDC14AMAPTALDH1A1
SCHEMBL22376927 0.92 CDC14B (0.36) ALOX5CDC14BCDC14AMAPTALDH1A1

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
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed