SCHEMBL19986087

SCHEMBL19986087

c1cc(-c2ccc3oc4ccccc4c3c2)cc(-n2c3ccccc3c3c4c5ccccc5c5ccccc5c4c4c5ccccc5oc4c32)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.34
PLA2G4A P47712 4/20 0.34
PLA2G10 O15496 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALOX5 P09917 1/20 0.33
RXFP1 Q9HBX9 2/20 0.32
LMNA P02545 2/20 0.32
PPARG P37231 1/20 0.32
NR2E3 Q9Y5X4 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
AHR P35869 1/20 0.31
CHEK2 O96017 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
SCHEMBL19986064 0.93 AHR (0.33) PLA2G2APLA2G4AALDH1A1KDM4EMEN1
SCHEMBL19986033 0.93 PLA2G2A (0.33) PLA2G2APLA2G4APLA2G10ALDH1A1KDM4E
SCHEMBL19986025 0.92 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10ALDH1A1KDM4E
SCHEMBL19986066 0.91 ALDH1A1 (0.35) PLA2G2APLA2G4APLA2G10ALDH1A1KDM4E
SCHEMBL19986057 0.91 ALDH1A1 (0.34) PLA2G2APLA2G4AALDH1A1KDM4EMEN1
SCHEMBL19986008 0.90 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10ALDH1A1KDM4E
SCHEMBL19986021 0.89 TDP1 (0.32) PLA2G2APLA2G4APLA2G10ALDH1A1KDM4E
SCHEMBL19986053 0.89 KDM4E (0.38) PLA2G2APLA2G4APLA2G10ALDH1A1KDM4E
SCHEMBL19986052 0.88 ALDH1A1 (0.38) ALDH1A1KDM4EMEN1KMT2ANPC1
SCHEMBL19986051 0.88 HSD17B1 (0.33) PLA2G2APLA2G4AALDH1A1KDM4ENPC1

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-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed