SCHEMBL3496181

SCHEMBL3496181

O=COCc1cc(OCC(=O)O)ccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PTPN7 P35236 1/20 0.41
ALDH1A1 P00352 5/20 0.41
MAPT P10636 4/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAOB P27338 1/20 0.40
AOC3 Q16853 1/20 0.40
CLK1 P49759 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PPARD Q03181 1/20 0.40
AURKA O14965 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL16294585 0.87 PTPN7 (0.45) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL29420163 0.87 PTPN7 (0.45) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL29005651 0.84 LMNA (0.46) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL29897187 0.84 LMNA (0.46) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL5030826 0.82 NPC1 (0.47) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL16285732 0.82 MAPT (0.49) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL5030823 0.82 PTPN7 (0.46) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL29899356 0.82 PPARD (0.45) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL3496177 0.82 MEN1 (0.41) MEN1KMT2APTPN7ALDH1A1MAPT
SCHEMBL29005892 0.82 PPARD (0.45) MEN1KMT2APTPN7ALDH1A1MAPT

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544736-B2 Methods of preparing latex particulates with reactive functional groups HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2009-06-09 US claimed
US-7291514-B2 Bottom electrode chemically-bonded Langmuir-Blodgett films via photolabile groups HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2007-11-06 US claimed
US-7175961-B2 Photopatternable molecular circuitry HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2007-02-13 US claimed
US-7144683-B2 Photopatternable molecular circuitry HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2006-12-05 US claimed
EP-1502929-B1 Methods of preparing latex particulates with reactive functional groups HEWLETT PACKARD DEVELOPMENT CO (US) 2006-05-10 EP claimed
US-20060047060-A1 Methods of preparing latex particulates with reactive functional groups ZHOU ZHANG-LIN 2006-03-02 US claimed
US-6995206-B2 Methods of preparing latex particulates with reactive functional groups HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2006-02-07 US claimed
US-20050194526-A1 Bottom electrode chemically-bonded Langmuir-Blodgett films via photolabile groups HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2005-09-08 US claimed
US-20050027065-A1 Methods and preparing latex particulates with reactive functional groups HEWLETT-PACKARD DEVELOPMENT COMPANY L.P. 2005-02-03 US claimed
EP-1502929-A1 Methods of preparing latex particulates with reactive functional groups Hewlett-Packard Development Company, L.P. (US) 2005-02-02 EP claimed
US-20040122233-A1 Photopatternable molecular circuitry BECK PATRICIA A (US) 2004-06-24 US claimed
US-20030194630-A1 Photopatternable molecular circuitry HEWLETT-PACKARD DEVELOPMENT COMPANY L.P. 2003-10-16 US claimed
US-20220411790-A1 A CRISPR-CAS9 PLATFORM WITH AN INTRINSIC OFF-SWITCH AND ENHANCED SPECIFICITY THE JOHNS HOPKINS UNIVERSITY 2022-12-29 US disclosed
WO-2021081468-A1 A CRISPR-CAS9 PLATFORM WITH AN INTRINSIC OFF-SWITCH AND ENHANCED SPECIFICITY THE JOHNS HOKINS UNIVERSITY (US) 2021-04-29 WO disclosed
EP-3587585-B1 METHODS, KITS, AND SYSTEMS FOR MULTIPLEXED DETECTION OF TARGET MOLECULES AND USES THEREOF MASSACHUSETTS GEN HOSPITAL (US) 2021-03-24 EP disclosed
US-10655163-B2 Methods, kits, and systems for multiplexed detection of target molecules and uses thereof THE GENERAL HOSPITAL CORPORATION (US) 2020-05-19 US disclosed
US-6410327-B2 Methods for the selective regulation of DNA and RNA transcription and translation by photoactivation VANDERBILT UNIVERSITY OFFICE OF TECHNOLOGY TRANSFER 2002-06-25 US disclosed
US-20010024830-A1 Methods for the selective regulation of DNA and RNA transcription and translation by photoactivation VANDERBILT UNIVERSITY 2001-09-27 US disclosed
US-6242258-B1 Methods for the selective regulation of DNA and RNA transcription and translation by photoactivation VANDERBILT UNIVERSITY 2001-06-05 US disclosed
US-6017758-A DMNPE caged nucleic acid and vector VANDERBILT UNIVERSITY (US) 2000-01-25 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-20040122233-A1 Photopatternable molecular circuitry CDH1, VIM, CAT MEN1 2873/4885KMT2A 710/4885PTPN7 2967/4885

“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.