SCHEMBL22065080

SCHEMBL22065080

c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccc3-n3c4ccccc4c4ccccc43)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.47
MAPK1 P28482 2/20 0.47
TSHR P16473 2/20 0.47
METAP1 P53582 6/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
DHODH Q02127 1/20 0.39
TP53 P04637 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
PKM P14618 2/20 0.39
RAB9A P51151 2/20 0.39
GRM5 P41594 1/20 0.39
KDM4E B2RXH2 4/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
ADORA3 P0DMS8 3/20 0.38
RXFP1 Q9HBX9 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL22065918 0.94 KDM4E (0.43) HSD17B10MAPK1TSHRMETAP1L3MBTL1
SCHEMBL22064958 0.92 TSHR (0.42) HSD17B10MAPK1TSHRMETAP1L3MBTL1
SCHEMBL22064960 0.92 TSHR (0.42) HSD17B10MAPK1TSHRMETAP1L3MBTL1
SCHEMBL22065071 0.92 TSHR (0.42) HSD17B10MAPK1TSHRMETAP1L3MBTL1
SCHEMBL17828459 0.89 MEN1 (0.42) TSHRL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL22064957 0.87 KDM4E (0.42) HSD17B10MAPK1TSHRMETAP1L3MBTL1
SCHEMBL22327532 0.87 MAPK1 (0.43) HSD17B10MAPK1TSHRMETAP1L3MBTL1
SCHEMBL26793655 0.87 KDM4E (0.47) HSD17B10MAPK1TSHRMETAP1L3MBTL1
SCHEMBL22065091 0.87 KDM4E (0.42) HSD17B10MAPK1METAP1L3MBTL1TP53
SCHEMBL22066215 0.85 METAP1 (0.38) HSD17B10MAPK1METAP1TP53SMN1; SMN2

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-20200185616-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE SAME LG DISPLAY CO., LTD (KR) 2020-06-11 US disclosed