SCHEMBL21163446

SCHEMBL21163446

Ic1ccc(-c2cc3ccccc3n2-c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.49
APP P05067 2/20 0.47
ALDH1A1 P00352 3/20 0.46
TSHR P16473 2/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP19A1 P11511 1/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ATM Q13315 1/20 0.37
AOC3 Q16853 3/20 0.36
KCNH2 Q12809 2/20 0.36
PDGFRB P09619 1/20 0.36
KDR P35968 1/20 0.36
PLA2G10 O15496 1/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL1878805 0.88 HAO1 (0.58) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL3867353 0.84 HAO1 (0.59) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL22171609 0.84 ALDH1A1 (0.53) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL13425022 0.84 HAO1 (0.62) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL23024879 0.83 AOC3 (0.52) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL11319062 0.83 HAO1 (0.52) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL28281366 0.83 HAO1 (0.49) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL13707395 0.83 APP (0.56) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL4883039 0.83 HAO1 (0.49) HAO1APPALDH1A1TSHRKMT2A
SCHEMBL13425013 0.81 KMT2A (0.55) HAO1APPALDH1A1TSHRKMT2A

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
US-20190207122-A1 ORGANIC LIGHT EMITTING DEVICE AND ORGANIC LIGHT EMITTING DISPLAY LG DISPLAY CO., LTD. (KR) 2019-07-04 US disclosed