Pyrene

Pyrene

SCHEMBL26656756

OCCO.c1cc2ccc3cccc4ccc(c1)c2c34.c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.69

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.69
HSD17B10 Q99714 6/20 0.69
HPGD P15428 6/20 0.69
TSHR P16473 5/20 0.69
CYP1A2 P05177 4/20 0.69
CYP3A4 P08684 3/20 0.69
CYP1A1 P04798 2/20 0.69
CYP1B1 Q16678 2/20 0.69
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
THRB P10828 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HEXA P06865 1/20 0.43
HEXB P07686 1/20 0.43
KDM4E B2RXH2 3/20 0.43
MAPK1 P28482 2/20 0.41
ATM Q13315 1/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41

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
Pyrene SCHEMBL105723 1.00 ALDH1A1 (0.69) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL27898322 0.87 ALDH1A1 (0.52) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL29078946 0.86 ALDH1A1 (0.58) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL1274682 0.85 ALDH1A1 (0.65) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL1332849 0.83 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL29429699 0.83 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL223412 0.83 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL1650929 0.83 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Pyrene SCHEMBL9130 0.83 ALDH1A1 (1.00) ALDH1A1HSD17B10HPGDTSHRCYP1A2
Ethylene Glycol SCHEMBL4050504 0.82 ALDH1A1 (0.55) ALDH1A1HSD17B10HPGDTSHRCYP1A2

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
WO-2023223692-A1 NONLINEAR LIGHT ABSORBING MATERIAL, RECORDING MEDIUM, METHOD FOR RECORDING INFORMATION, AND METHOD FOR READING INFORMATION パナソニックIPマネジメント株式会社 2023-11-23 WO disclosed
WO-2023223693-A1 RECORDING MEDIUM, INFORMATION RECORDING METHOD, AND INFORMATION READING METHOD パナソニックIPマネジメント株式会社 2023-11-23 WO disclosed