SCHEMBL5474368

SCHEMBL5474368

c1cc2ccc3c4ccc5ccc6ccc7c8ccc9ccc%10ccc%11c%12ccc1c1c2c3c2c(c%121)c1c%11c%10c9c8c1c1c7c6c5c4c21

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
HSD17B10 Q99714 4/20 0.45
CYP1A2 P05177 3/20 0.45
HPGD P15428 3/20 0.45
THRB P10828 1/20 0.45
TSHR P16473 4/20 0.41
CYP3A4 P08684 3/20 0.41
CYP1A1 P04798 1/20 0.41
CYP1B1 Q16678 1/20 0.41
ERBB2 P04626 1/20 0.40
FYN P06241 1/20 0.40
MAOA P21397 1/20 0.40
ACHE P22303 1/20 0.40
AHR P35869 1/20 0.40
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPRT1 P00492 1/20 0.35
CYP2A6 P11509 1/20 0.32

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
SCHEMBL5477100 1.00 ALDH1A1 (0.45) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5479659 0.87 CYP1A2 (0.44) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL1258342 0.85 HSD17B10 (0.62) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5473975 0.85 HSD17B10 (0.62) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4444195 0.85 HSD17B10 (0.62) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL30161182 0.85 HSD17B10 (0.62) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4853027 0.85 ALDH1A1 (0.70) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4074844 0.84
SCHEMBL9157679 0.83 HSD17B10 (0.68) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL29613397 0.83 HSD17B10 (0.68) ALDH1A1HSD17B10CYP1A2HPGDTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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