SCHEMBL19985937

SCHEMBL19985937

c1ccc(-c2cccc(-n3c4ccccc4c4c5c6ccccc6c6ccccc6c5c5c6ccccc6sc5c43)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TP53 P04637 2/20 0.35
ATM Q13315 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
HSD17B10 Q99714 1/20 0.32
FAAH O00519 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PKM P14618 1/20 0.32
MGLL Q99685 1/20 0.32
WNK1 Q9H4A3 1/20 0.32
LIMK1 P53667 1/20 0.31
KMT2A Q03164 2/20 0.31
IL1R1 P14778 1/20 0.31
HTR1A P08908 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
SCHEMBL19985938 0.99 MAPT (0.36) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL19985920 0.99 MAPT (0.36) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL19985932 0.93 MAPT (0.35) MAPTRXFP1TP53LIMK1ALOX5
SCHEMBL22960405 0.93 MAPT (0.37) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL23960976 0.93 MAPT (0.37) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL22960418 0.92 MAPT (0.36) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL19985904 0.92 KDM4E (0.33) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL19985903 0.91 TNKS (0.33) MAPTRXFP1ATML3MBTL1KDM4E
SCHEMBL19985974 0.91 KDM4E (0.38) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL19985941 0.91 KDM4E (0.38) MAPTRXFP1TP53ATML3MBTL1

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