Pyrene

Pyrene

SCHEMBL678886

C=C(C)C(=O)OC.c1cc2ccc3cccc4ccc(c1)c2c34

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
HPGD P15428 4/20 0.46
KDM4E B2RXH2 3/20 0.46
MAPT P10636 3/20 0.46
HSD17B10 Q99714 3/20 0.42
CYP3A4 P08684 2/20 0.42
TSHR P16473 2/20 0.42
CYP1A1 P04798 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP1B1 Q16678 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ELANE P08246 1/20 0.38
POLB P06746 2/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 2/20 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
SCHEMBL28145291 0.88 ALDH1A1 (0.48) ALDH1A1HPGDKDM4EMAPTCYP1A2
SCHEMBL28161020 0.86 ALDH1A1 (0.50) ALDH1A1HPGDKDM4EMAPTHSD17B10
Naphthalene SCHEMBL4378459 0.86 ALDH1A1 (0.65) ALDH1A1KDM4EMAPTTSHRCYP1A2
Anthracene SCHEMBL909619 0.82 ALDH1A1 (0.60) ALDH1A1HPGDKDM4EMAPTTSHR
SCHEMBL28157624 0.81 ALDH1A1 (0.58) ALDH1A1HPGDKDM4EMAPTCYP1A2
Pyrene SCHEMBL17023864 0.79 KMT2A (0.52) ALDH1A1HPGDKDM4EMAPTHSD17B10
SCHEMBL28989631 0.79 ELANE (0.47) ALDH1A1HPGDKDM4EMAPTHSD17B10
Benzene SCHEMBL28395547 0.79 ALDH1A1 (0.83) ALDH1A1KDM4EMAPTHSD17B10TSHR
Benzene SCHEMBL27313869 0.79 ALDH1A1 (0.83) ALDH1A1KDM4EMAPTHSD17B10TSHR
Pyrene SCHEMBL28662784 0.78 KMT2A (0.50) ALDH1A1HPGDKDM4EMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113527602-B Photo-responsive block polymer synthesized by ATRP method and preparation method and application thereof 佳化化学科技发展(上海)有限公司 2024-04-26 CN disclosed
CN-113939544-B non-core-shell polymer particles 悉尼大学 2023-08-22 CN disclosed
US-20220177659-A1 NON-CORE SHELL POLYMER PARTICLES THE UNIVERSITY OF SYDNEY (AU) 2022-06-09 US disclosed
EP-3947476-A1 NON-CORE-SHELL POLYMER PARTICLES The University of Sydney (AU) 2022-02-09 EP disclosed
CN-113939544-A Non-core-shell polymer particles 悉尼大学 2022-01-14 CN disclosed
CN-113527602-A Photoresponse block polymer synthesized by ATRP method and preparation method and application thereof 佳化化学科技发展(上海)有限公司 2021-10-22 CN disclosed
WO-2020198789-A1 NON-CORE-SHELL POLYMER PARTICLES THE UNIVERSITY OF SYDNEY (AU) 2020-10-08 WO disclosed
CN-107129559-B A method of utilizing fluorescent molecule trace polymerization analyte detection deca-BDE 福建师范大学 2019-05-07 CN disclosed
CN-107129559-B A method of utilizing fluorescent molecule trace polymerization analyte detection deca-BDE 福建师范大学 2019-05-07 CN disclosed
CN-107129559-A A kind of method of utilization fluorescence molecule trace polymerization analyte detection deca-BDE 福建师范大学 2017-09-05 CN disclosed
CN-107129559-A A kind of method of utilization fluorescence molecule trace polymerization analyte detection deca-BDE 福建师范大学 2017-09-05 CN disclosed
CN-103113595-B Fluorescent block-grafted copolymer with temperature sensitivity and preparation method and application thereof CAS GUANGZHOU CHEMISTRY CO LTD 2014-11-19 CN disclosed
CN-103113595-A Fluorescent block-grafted copolymer with temperature sensitivity and preparation method and application thereof CAS GUANGZHOU CHEMISTRY CO LTD 2013-05-22 CN disclosed
US-20110286935-A1 Multi-Functional Nano-Device ATRP Solutions, Inc. (US) 2011-11-24 US disclosed
US-6218468-B1 CARRIED OUT IN THE PRESENCE OF FROZEN MICELLES OF AMPHIPHILIC SUBSTANCES. BASF AKTIENGESELLSCHAFT (DE) 2001-04-17 US 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 (1 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-20110286935-A1 Multi-Functional Nano-Device CD47, FCGRT, FCGR3B ALDH1A1 2541/4885HPGD 3968/4885KDM4E 2824/4885

“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.