SCHEMBL19986008

SCHEMBL19986008

c1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)c3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.35
PLA2G4A P47712 3/20 0.35
ALDH1A1 P00352 5/20 0.34
POLB P06746 2/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
BRCA1 P38398 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RXFP1 Q9HBX9 3/20 0.33
KDM4E B2RXH2 3/20 0.33
PPARG P37231 2/20 0.33
NR2E3 Q9Y5X4 2/20 0.33
NCOR2 Q9Y618 2/20 0.33
ATM Q13315 2/20 0.33
LMNA P02545 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PLA2G10 O15496 1/20 0.33
WNK1 Q9H4A3 1/20 0.33
FAAH O00519 1/20 0.31

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
SCHEMBL19986057 0.99 ALDH1A1 (0.34) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986025 0.98 PLA2G2A (0.35) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986020 0.93 PLA2G2A (0.38) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986018 0.93 MEN1 (0.35) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986033 0.92 PLA2G2A (0.33) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986053 0.90 KDM4E (0.38) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986038 0.90 KDM4E (0.38) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986064 0.90 AHR (0.33) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986087 0.90 PLA2G2A (0.34) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19986122 0.89 MAPT (0.36) ALDH1A1POLBMEN1TSHRKMT2A

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