SCHEMBL17691925

SCHEMBL17691925

c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4ccc5c(ccc6ccccc65)c4)n3)ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
HSD17B10 Q99714 3/20 0.52
CYP1B1 Q16678 3/20 0.52
HIF1A Q16665 1/20 0.52
HPRT1 P00492 3/20 0.50
CYP2A6 P11509 1/20 0.48
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
CYP1A1 P04798 2/20 0.45
GSTP1 P09211 1/20 0.44
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
CYP1A2 P05177 4/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL22186310 1.00 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL23759548 0.98 HPRT1 (0.54) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL23759351 0.98 HPRT1 (0.54) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL22186525 0.96 ALDH1A1 (0.56) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL17691926 0.94 ALDH1A1 (0.51) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL24306524 0.93 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL23759303 0.93 HPRT1 (0.48) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL26047132 0.93 HPRT1 (0.48) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL23759340 0.93 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL23759450 0.92 HPRT1 (0.52) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1

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 4 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-20190036043-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-01-31 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