SCHEMBL27363887

SCHEMBL27363887

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6ccccc6ccc54)c4c3oc3ccc5ccccc5c34)nc3c2oc2ccc(-c4cccc5c4oc4ccccc45)cc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
PRKDC P78527 1/20 0.34
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
GGPS1 O95749 1/20 0.31
MAPT P10636 2/20 0.30
KDM4E B2RXH2 2/20 0.30
TSHR P16473 2/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30
ALDH1A1 P00352 2/20 0.30
HPGD P15428 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL27363886 0.97 ALOX5 (0.36) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL30019744 0.89 PIM1 (0.35) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL27081847 0.89 PIM1 (0.35) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL27364094 0.87 ALDH1A1 (0.33) ALOX5PIM1CSNK2A2CSNK2BPIM3
SCHEMBL27363971 0.87 PIM1 (0.37) PRKDCPIM1CSNK2A2CSNK2BPIM3
SCHEMBL27363968 0.84 PIM1 (0.38) PRKDCPIM1CSNK2A2CSNK2BPIM3
SCHEMBL27363951 0.84 ALDH1A1 (0.35) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL27364522 0.83 ALDH1A1 (0.37) MAPTKDM4ETSHRLMNAMAPK1
SCHEMBL27364125 0.83 ALOX5 (0.36) ALOX5PRKDCPIM1CSNK2A2CSNK2B
SCHEMBL27364108 0.83 ALDH1A1 (0.35) PIM1CSNK2A2CSNK2BPIM3PIM2

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-20240215277-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2024-06-27 US disclosed
US-20240215277-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2024-06-27 US disclosed