SCHEMBL17691982

SCHEMBL17691982

c1cnc(-c2cc3ccc4ccccc4c3c3ccccc23)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
HSD17B10 Q99714 6/20 0.44
HPGD P15428 5/20 0.44
TSHR P16473 4/20 0.44
HIF1A Q16665 4/20 0.44
CYP3A4 P08684 4/20 0.44
MAPK1 P28482 4/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
CASP1 P29466 2/20 0.44
AHR P35869 2/20 0.40
CYP1A2 P05177 2/20 0.40
ERBB2 P04626 1/20 0.40
FYN P06241 1/20 0.40
MAOA P21397 1/20 0.40
ACHE P22303 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP2A6 P11509 2/20 0.39
MAPT P10636 4/20 0.39
KDM4E B2RXH2 4/20 0.39
CCR1 P32246 3/20 0.39

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
SCHEMBL13408713 0.88 ALDH1A1 (0.45) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL17692334 0.86 HPRT1 (0.43) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL17691987 0.86 ALDH1A1 (0.42) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL17691979 0.85 ALDH1A1 (0.39) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL17692008 0.82 MAPT (0.47) ALDH1A1HSD17B10HPGDTSHRMAPK1
SCHEMBL17691996 0.82 AHR (0.51) ALDH1A1HSD17B10HPGDHIF1ACYP3A4
SCHEMBL27865920 0.81 CYP1A2 (0.48) ALDH1A1HSD17B10HPGDTSHRHIF1A
SCHEMBL12014502 0.81 MEN1 (0.39) ALDH1A1HSD17B10HPGDTSHRCYP3A4
SCHEMBL17692026 0.81 KDM4E (0.42) ALDH1A1HPGDTSHRHIF1ACYP3A4
SCHEMBL28910616 0.80 CYP11B1 (0.52) ALDH1A1HSD17B10HPGDTSHRHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10826000-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-11-03 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed