SCHEMBL19986139

SCHEMBL19986139

c1ccc(-c2cccc(-c3nc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)nc4c3oc3ccccc34)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.35
TSHR P16473 4/20 0.35
ALDH1A1 P00352 6/20 0.33
LMNA P02545 4/20 0.33
KDM4E B2RXH2 3/20 0.33
HSD17B10 Q99714 3/20 0.33
POLB P06746 2/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
CREBBP Q92793 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ADORA2A P29274 1/20 0.33
USP2 O75604 1/20 0.32
HTT P42858 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 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
SCHEMBL19986141 0.93 MAPT (0.37) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL19986140 0.93 MAPT (0.38) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL19986103 0.89 ALDH1A1 (0.37) MAPTALDH1A1LMNAKDM4EHSD17B10
SCHEMBL19382743 0.89 MAPT (0.37) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL19986147 0.89 TDP1 (0.30)
SCHEMBL19986189 0.88 MAPT (0.32) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL19890959 0.88 MAPT (0.36) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL19986137 0.87 ESR1 (0.30)
SCHEMBL19046693 0.87 MAPT (0.38) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL22200011 0.87 MAPT (0.38) MAPTTSHRALDH1A1LMNAKDM4E

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