SCHEMBL19985955

SCHEMBL19985955

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7sc6c54)c3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.34
MEN1 O00255 5/20 0.34
KMT2A Q03164 5/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
KDM4E B2RXH2 3/20 0.34
LMNA P02545 2/20 0.34
RXFP1 Q9HBX9 1/20 0.33
TP53 P04637 1/20 0.31
NTSR1 P30989 1/20 0.31
GLA P06280 1/20 0.30
POLB P06746 1/20 0.30
DUSP3 P51452 1/20 0.30
PTPN5 P54829 1/20 0.30
PTPN11 Q06124 1/20 0.30
CTDSP1 Q9GZU7 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
SCHEMBL19039776 0.95 MAPT (0.35) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19986185 0.94 MAPT (0.34) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL17405694 0.92 MAPT (0.35) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL17405411 0.92 MAPT (0.35) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19986041 0.91 MAPT (0.32) MAPTRXFP1TP53
SCHEMBL17405805 0.91 MAPT (0.34) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL17406033 0.91 MAPT (0.34) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL17990979 0.90 MEN1 (0.34) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL17405750 0.90 MAPT (0.35) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL17405494 0.90 MAPT (0.35) MAPTMEN1KMT2AALDH1A1HPGD

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