SCHEMBL24155747

SCHEMBL24155747

c1ccc(-c2nc3ccccc3s2)c(-c2ccc(Nc3cccc4c3sc3ccccc34)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 6/20 0.47
▸ KDR P35968 6/20 0.47
▸ EGFR P00533 5/20 0.47
▸ IGF1R P08069 4/20 0.47
▸ SRC P12931 4/20 0.47
▸ AURKB Q96GD4 3/20 0.47
▸ TEK Q02763 3/20 0.47
▸ INSR P06213 3/20 0.47
▸ EPHB4 P54760 1/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ APP P05067 2/20 0.45
▸ GLA P06280 1/20 0.45
▸ FLT4 P35916 3/20 0.44
▸ ERBB2 P04626 1/20 0.44
▸ TP53 P04637 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ MAPT P10636 2/20 0.42
▸ NPC1 O15118 1/20 0.42

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
SCHEMBL20553578 0.82 PARP14 (0.44) AURKAKDREGFRIGF1RSRC
SCHEMBL24156119 0.80 MAPT (0.47) AURKAKDREGFRIGF1RSRC
SCHEMBL30954652 0.80 MAPT (0.47) AURKAKDREGFRIGF1RSRC
SCHEMBL24944486 0.79 PARP14 (0.41) KDRMEN1GAAKMT2AGLA
SCHEMBL23328432 0.79 NPC1 (0.57) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL15138713 0.77 KDM4E (0.46) KDREGFRMEN1GAAKMT2A
SCHEMBL30746697 0.77 KDM4E (0.46) KDREGFRMEN1GAAKMT2A
SCHEMBL23690157 0.77 KDM4E (0.46) KDREGFRMEN1GAAKMT2A
SCHEMBL23258306 0.77 ALOX5 (0.42) AURKAKDREGFRIGF1RSRC
SCHEMBL29892406 0.77 ALOX5 (0.42) AURKAKDREGFRIGF1RSRC

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021261851-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT 덕산네오룩스 주식회사 2021-12-30 — — WO disclosed
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