SCHEMBL25458064

SCHEMBL25458064

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5ccc6sc7c(-c8ccccc8)cccc7c6c5)c5oc6ccccc6c45)c3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.39
CDC14B O60729 2/20 0.35
CDC14A Q9UNH5 2/20 0.35
PRKDC P78527 1/20 0.35
MAPT P10636 4/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
LIMK1 P53667 2/20 0.33
TSHR P16473 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
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HPGD P15428 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
SCHEMBL26223052 0.95 ALOX5 (0.35) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL26223048 0.95 ALOX5 (0.35) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL25458114 0.95 ALOX5 (0.45) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL26240687 0.95 ALOX5 (0.37) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL26240723 0.95 ALOX5 (0.37) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL26763085 0.94 ALOX5 (0.37) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL26219821 0.94 ALOX5 (0.37) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL26226315 0.94 ALOX5 (0.37) ALOX5CDC14BCDC14APRKDCMAPT
SCHEMBL25458042 0.93 ALOX5 (0.36) ALOX5PRKDCMAPTKDM4EALDH1A1
SCHEMBL26763621 0.93 ALOX5 (0.36) ALOX5CDC14BCDC14APRKDCMAPT

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