Pyrene

Pyrene

SCHEMBL223706

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ HPGD P15428 4/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ TSHR P16473 4/20 0.44
▸ CYP1A2 P05177 3/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ CYP1A1 P04798 2/20 0.44
▸ CYP1B1 Q16678 2/20 0.44
▸ STAT3 P40763 1/20 0.38
▸ STAT1 P42224 1/20 0.38
▸ ERBB2 P04626 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ L3MBTL1 Q9Y468 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
Pyrene SCHEMBL27924575 0.98 CYP1A2 (0.42) ALDH1A1HPGDHSD17B10TSHRCYP1A2
SCHEMBL3116089 0.89 CYP1A2 (0.39) ALDH1A1HPGDHSD17B10TSHRCYP1A2
SCHEMBL9718813 0.87 STAT3 (0.41) STAT3STAT1
SCHEMBL27629845 0.87 CYP1A2 (0.38) ALDH1A1HPGDHSD17B10TSHRCYP1A2
Naphthalene SCHEMBL1608581 0.85 STAT3 (0.45) ALDH1A1HPGDHSD17B10CYP1A2CYP3A4
Benzene SCHEMBL29181649 0.85 STAT3 (0.47) ALDH1A1HSD17B10STAT3STAT1KDM4E
Benzene SCHEMBL1525265 0.85 STAT3 (0.47) ALDH1A1HSD17B10STAT3STAT1KDM4E
SCHEMBL6517023 0.85 STAT3 (0.42) STAT3STAT1
SCHEMBL6744970 0.85 STAT3 (0.42) STAT3STAT1
SCHEMBL9430673 0.85 STAT3 (0.42) STAT3STAT1

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-108503849-A A method of detecting fingerprint with fluorescence probe 北京化工大学 2018-09-07 — — CN claimed
US-9837611-B2 Photo-switchable fullerene-based materials as interfacial layers in organic photovoltaics BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-12-05 — — US claimed
US-20130074920-A1 Photo-Switchable Fullerene-Based Materials as Interfacial Layers in Organic Photovoltaics BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-03-28 — — US claimed
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
US-10256421-B2 Fusing porphyrins with polycyclic aromatic hydrocarbons and heterocycles for optoelectronic applications UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2019-04-09 — — US disclosed
CN-108503849-A A method of detecting fingerprint with fluorescence probe 北京化工大学 2018-09-07 — — CN disclosed
US-9837611-B2 Photo-switchable fullerene-based materials as interfacial layers in organic photovoltaics BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-12-05 — — US disclosed
EP-2470543-B1 VISIBLE/NIR PHOTODETECTORS UNIV MICHIGAN REGENTS (US) 2017-07-26 — — EP disclosed
US-20170092883-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2017-03-30 — — US disclosed
US-20150280149-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2015-10-01 — — US disclosed
US-9113535-B2 Fusing porphyrins with polycyclic aromatic hydrocarbons and heterocycles for optoelectronic applications THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2015-08-18 — — US disclosed
CN-103119046-A Fusing porphyrins with polycyclic aromatic hydrocarbons and heterocycles for optoelectric applications UNIV SOUTHERN CALIFORNIA 2013-05-22 — — CN disclosed
EP-2590983-A2 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRIC APPLICATIONS The University Of Southern California (US) 2013-05-15 — — EP disclosed
US-20130074920-A1 Photo-Switchable Fullerene-Based Materials as Interfacial Layers in Organic Photovoltaics BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-03-28 — — US disclosed
EP-2470543-A1 VISIBLE/NIR PHOTODETECTORS The Regents of the University of Michigan (US) 2012-07-04 — — EP disclosed
WO-2012012117-A2 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRIC APPLICATIONS The University of Southern California USC Stevens Institute for Innovation (US) 2012-01-26 — — WO disclosed
US-20120001155-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-01-05 — — US disclosed
WO-2011028610-A1 VISIBLE/NIR PHOTODETECTORS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-03-10 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10256421-B2 Fusing porphyrins with polycyclic aromatic hydrocarbons and heterocycles for optoelectronic applications PPOX, HMBS, TYR ALDH1A1 4786/4885HPGD 1197/4885HSD17B10 3003/4885
US-20150280149-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS PPOX, HMBS, TYR ALDH1A1 4788/4885HPGD 1086/4885HSD17B10 2850/4885
US-20120001155-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS PPOX, HMBS, NONO ALDH1A1 4789/4885HPGD 1295/4885HSD17B10 2857/4885
US-20170092883-A1 FUSING PORPHYRINS WITH POLYCYCLIC AROMATIC HYDROCARBONS AND HETEROCYCLES FOR OPTOELECTRONIC APPLICATIONS PPOX, HMBS, TYR ALDH1A1 4788/4885HPGD 1086/4885HSD17B10 2850/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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