SCHEMBL19986122

SCHEMBL19986122

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)c3)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.36
TSHR P16473 4/20 0.36
ALDH1A1 P00352 4/20 0.34
LMNA P02545 4/20 0.34
KDM4E B2RXH2 3/20 0.34
POLB P06746 2/20 0.34
HSD17B10 Q99714 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
USP2 O75604 1/20 0.33
HTT P42858 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 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
SCHEMBL17405642 0.94 MAPT (0.36) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL19986199 0.94 MAPT (0.34) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL17405172 0.94 MAPT (0.36) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL17406085 0.94 MAPT (0.36) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL18505627 0.93 MAPT (0.37) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL17405515 0.93 MAPT (0.37) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL16867287 0.92 MAPT (0.36) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL17405373 0.92 MAPT (0.36) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL17405779 0.92 MAPT (0.36) MAPTTSHRALDH1A1LMNAKDM4E
SCHEMBL24171786 0.92 MAPT (0.35) 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