SCHEMBL997025

SCHEMBL997025

Cc1ccc(C(=O)C2C(=O)N(C)OC(C)(C)C2=O)c([N+](=O)[O-])c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
HPD P32754 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALDH1A1 P00352 7/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 3/20 0.37
HTT P42858 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
KCNMA1 Q12791 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL998548 0.88 SMN1; SMN2 (0.43) HPDCYP3A4POLBLMNASMN1; SMN2
SCHEMBL997023 0.86 HPD (0.36) HPDALDH1A1POLBMAPTMEN1
SCHEMBL9441394 0.83 HPD (0.36) HPDCYP3A4ALDH1A1MAPTHTT
SCHEMBL997179 0.83 HPD (0.40) HPDALDH1A1MAPTHTTMEN1
SCHEMBL14155650 0.77 TSHR (0.44) TSHRHPDCYP3A4ALDH1A1POLB
SCHEMBL9871935 0.73 SMN1; SMN2 (0.48) HPDCYP3A4POLBLMNASMN1; SMN2
SCHEMBL13327441 0.72 HPD (0.67) TSHRHPDCYP3A4ALDH1A1MAPT
SCHEMBL9711467 0.70 HPD (0.43) TSHRHPDCYP3A4ALDH1A1POLB
SCHEMBL9739114 0.69 HPD (0.38) HPDALDH1A1POLBMAPTMEN1
SCHEMBL8713774 0.68 SMN1; SMN2 (0.46) HPDCYP3A4POLBLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614606-B1 Herbicidal compositions BASF AG (DE) 2003-09-10 EP claimed
US-5990046-A AGGREGATE AMOUNT OF A TRIKETONE OR DIONE HERBICIDE SUCH AS SULCOTRIONE, AND DIMETHENAMID IN A WEIGHT RATIO BETWEEN 1:2 AND 1:10; CONTROLLING WEEDS IN THE PRESENCE OF A CROP; IMPROVED HERBICIDAL ACTIVITY SANDOZ LTD. (CH) 1999-11-23 US claimed
US-20140234225-A1 METHOD OF TREATMENT USING NANOPARTICULATE COMPOSITIONS HAVING LYSOZYME AS A SURFACE STABILIZER ALKERMES PHARMA IRELAND LIMITED (IE) 2014-08-21 US disclosed
US-8652464-B2 Method of treatment using nanoparticulate compositions having lysozyme as a surface stabilizer ALKERMES PHARMA IRELAND LIMITED (IE) 2014-02-18 US disclosed
US-20130224123-A1 NANOPARTICULATE COMPOSITIONS HAVING LYSOZYME AS A SURFACE STABILIZER ALKERMES PHARMA IRELAND LIMITED (IE) 2013-08-29 US disclosed
US-8323641-B2 Nanoparticulate compositions having lysozyme as a surface stabilizer ALKERMES PHARMA IRELAND LIMITED (IE) 2012-12-04 US disclosed
EP-2272342-B1 Herbicidal compositions BASF SE (DE) 2012-06-27 EP disclosed
EP-2272342-A2 Herbicidal compositions BASF SE (DE) 2011-01-12 EP disclosed
EP-2272341-A2 Herbizide Zusammensetzungen BASF SE (DE) 2011-01-12 EP disclosed
US-7850995-B2 Bioadhesive nanoparticulate compositions having cationic surface stabilizers ELAN PHARMA INTERNATIONAL, LTD. (IE) 2010-12-14 US disclosed
EP-1810570-B1 Herbicidal compositions BASF SE (DE) 2009-07-15 EP disclosed
US-5877118-A CARBOXYLIC ACID-SUBSTITUTED AROMATIC SEMICARBAZONES BASF AKTIENGESELLSCHAFT (DE) 1999-03-02 US disclosed
US-5721191-A APPLYING CONCURRENTLY SANDOZ LTD. (CH) 1998-02-24 US disclosed
US-5686387-A HERBICIDE POTENTIATORS BASF AKTIENGESELLSCHAFT (DE) 1997-11-11 US disclosed
US-5683960-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-11-04 US disclosed
US-5681793-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-28 US disclosed
US-5665673-A SEMICARBAZONES BASF AKTIENGESELLSCHAFT (DE) 1997-09-09 US disclosed
US-5665674-A SEMICARBAZONES SANDOZ LTD. (CH) 1997-09-09 US disclosed
EP-0646315-A1 Novel compositions containing an auxin transport inhibitor and another herbicide SANDOZ LTD. (CH) 1995-04-05 EP disclosed
EP-0614606-A2 Herbicidal compositions SANDOZ LTD. (CH) 1994-09-14 EP 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 (2 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-20140234225-A1 METHOD OF TREATMENT USING NANOPARTICULATE COMPOSITIONS HAVING LYSOZYME AS A SURFACE STABILIZER LPO, LCT, LIPA TSHR 939/4885HPD 1827/4885CYP3A4 1290/4885
US-20130224123-A1 NANOPARTICULATE COMPOSITIONS HAVING LYSOZYME AS A SURFACE STABILIZER LPO, LCT, CTSA TSHR 1167/4885HPD 1972/4885CYP3A4 1286/4885

“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.