Pyrene

Pyrene

SCHEMBL6512596

c1cc2ccc3cccc4ccc(c1)c2c34.c1ccncc1

nearest known ligand 0.61

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.61
ALDH1A1 P00352 6/20 0.61
CYP3A4 P08684 5/20 0.61
HSD17B10 Q99714 5/20 0.61
CYP1A2 P05177 5/20 0.61
HPGD P15428 4/20 0.61
CYP1A1 P04798 3/20 0.61
CYP1B1 Q16678 3/20 0.61
TDP1 Q9NUW8 4/20 0.50
NAPRT Q6XQN6 1/20 0.50
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
THRB P10828 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38

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 SCHEMBL28557577 1.00 TSHR (0.61) TSHRALDH1A1CYP3A4HSD17B10CYP1A2
Pyrene SCHEMBL6517542 1.00 TSHR (0.61) TSHRALDH1A1CYP3A4HSD17B10CYP1A2
Pyridine SCHEMBL5476777 0.85 ALDH1A1 (0.58) TSHRALDH1A1CYP3A4HSD17B10CYP1A2
Pyridine SCHEMBL2801205 0.84 CYP1A2 (0.50) TSHRALDH1A1CYP3A4HSD17B10CYP1A2
Pyrene SCHEMBL27961097 0.83 ALDH1A1 (0.61) TSHRALDH1A1CYP3A4HSD17B10CYP1A2
Pyrene SCHEMBL1993071 0.82 ALDH1A1 (0.92) TSHRALDH1A1CYP3A4HSD17B10CYP1A2
Pyrene SCHEMBL4977930 0.82 ALDH1A1 (0.92) TSHRALDH1A1CYP3A4HSD17B10CYP1A2
Naphthalene SCHEMBL28339834 0.79 TDP1 (0.60) TSHRALDH1A1CYP3A4CYP1A2TDP1
Naphthalene SCHEMBL1847628 0.79 TDP1 (0.60) TSHRALDH1A1CYP3A4CYP1A2TDP1
Pyrene SCHEMBL1650929 0.78 ALDH1A1 (1.00) TSHRALDH1A1CYP3A4HSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110563636-B Conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2020-12-08 CN claimed
CN-110563636-A conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2019-12-13 CN claimed
CN-106153589-B Cup pyridine is in neutral physiological ph aqueous solution to the Selective recognition method of acidic amino acid 天津师范大学 2018-12-25 CN claimed
CN-121873376-A Supermolecule fluorescent probe and preparation method and application thereof 华东理工大学 2026-04-17 CN disclosed
CN-116284078-A Long-wavelength AIE array sensor and preparation method and application thereof 南京农业大学 2023-06-23 CN disclosed
CN-110563636-B Conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2020-12-08 CN disclosed
CN-110563636-B Conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2020-12-08 CN disclosed
CN-110563636-B Conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2020-12-08 CN disclosed
CN-110563636-A conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2019-12-13 CN disclosed
CN-110563636-A conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2019-12-13 CN disclosed
CN-110563636-A conjugated polymer containing pyrene-pyridine group and synthetic method and application thereof 湖南师范大学 2019-12-13 CN disclosed
CN-106153589-B Cup pyridine is in neutral physiological ph aqueous solution to the Selective recognition method of acidic amino acid 天津师范大学 2018-12-25 CN disclosed
CN-108701766-A ORGANIC PHOTODETECTOR WITH REDUCED DARK CURRENT 剑桥显示技术有限公司 2018-10-23 CN disclosed
CN-103242174-B Aminated compounds and the Organic Light Emitting Diode comprising the aminated compounds 三星显示有限公司 2017-07-07 CN disclosed
CN-106153589-A Cup pyridine Selective recognition method to acidic amino acid in neutral physiological ph aqueous solution 天津师范大学 2016-11-23 CN disclosed
CN-104062335-B The method and apparatus that electrochemistry COD associating water quality heavy metal ion is monitored automatically 四川碧朗科技有限公司 2016-08-03 CN disclosed
US-6893716-B2 Non-covalent assembly of multilayer thin film supramolecular structures WORCESTER POLYTECHNIC INSTITUTE (US) 2005-05-17 US disclosed
US-20040110009-A1 Non-covalent assembly of multilayer thin film supramolecular structures WORCESTER POLYTECHNIC INSTITUTE 2004-06-10 US disclosed