SCHEMBL5482727

SCHEMBL5482727

c1ccc2c(c1)c1ccccc1c1cc3c(cc21)c1cccc2c4ccccc4c4cccc3c4c21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 7/20 0.55
CYP1A2 P05177 7/20 0.55
ALDH1A1 P00352 6/20 0.55
HPGD P15428 5/20 0.55
THRB P10828 2/20 0.55
TSHR P16473 4/20 0.42
HIF1A Q16665 2/20 0.42
CASP1 P29466 2/20 0.42
ERBB2 P04626 1/20 0.42
FYN P06241 1/20 0.42
MAOA P21397 1/20 0.42
ACHE P22303 1/20 0.42
AHR P35869 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HPRT1 P00492 3/20 0.38
TRPM4 Q8TD43 1/20 0.36
CYP2A6 P11509 4/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP1B1 Q16678 1/20 0.35

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
SCHEMBL4847348 0.91 ALDH1A1 (0.48) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL17044178 0.90 ALDH1A1 (0.52) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL2538508 0.89 CYP1A2 (0.65) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL29511306 0.89 CYP1A2 (0.65) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL4846327 0.88 ALDH1A1 (0.50) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL5473858 0.88 ALDH1A1 (0.50) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL26985 0.86 CYP1A2 (0.61) HSD17B10CYP1A2ALDH1A1HPGDTHRB
Triphenylene SCHEMBL21679566 0.86 CYP1A2 (0.61) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL29562533 0.86 CYP1A2 (0.61) HSD17B10CYP1A2ALDH1A1HPGDTHRB
SCHEMBL4764427 0.86 CYP1A2 (0.61) HSD17B10CYP1A2ALDH1A1HPGDTHRB

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-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-7175922-B2 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY (US) 2007-02-13 US disclosed
US-20050106415-A1 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2005-05-19 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed