SCHEMBL17945331

SCHEMBL17945331

c1ccc(-c2c3ccccc3c(-c3ccc4cc(-c5cc6c7ccccc7oc6c6oc7ccccc7c56)ccc4c3)c3ccccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
AHR P35869 2/20 0.35
CDC14B O60729 2/20 0.35
CDC14A Q9UNH5 2/20 0.35
ADORA2A P29274 1/20 0.35
GPR84 Q9NQS5 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
PLA2G2A P14555 2/20 0.33
PLA2G4A P47712 2/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL17932184 0.94 ALOX5 (0.40) ALOX5AHRGPR84KDM4EALDH1A1
SCHEMBL19081636 0.93 ESR1 (0.35) ALOX5AHRCDC14BCDC14AADORA2A
SCHEMBL17944788 0.93 ALOX5 (0.40) ALOX5AHRCDC14BCDC14AGPR84
SCHEMBL17945077 0.92 ALOX5 (0.36) ALOX5AHRCDC14BCDC14AGPR84
SCHEMBL17945581 0.91 PGR (0.37) ALOX5AHRCDC14BCDC14AADORA2A
SCHEMBL17945327 0.91 ALOX5 (0.40) ALOX5AHRCDC14BCDC14AADORA2A
SCHEMBL17932143 0.91 ALOX5 (0.42) ALOX5AHRCDC14BCDC14AADORA2A
SCHEMBL17932131 0.91 CDC14B (0.41) ALOX5AHRCDC14BCDC14AADORA2A
SCHEMBL17944087 0.88 ALOX5 (0.37) ALOX5AHRGPR84KDM4EALDH1A1
SCHEMBL17944158 0.88 ALOX5 (0.37) ALOX5AHRCDC14BCDC14AADORA2A

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-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed