SCHEMBL10111520

SCHEMBL10111520

COC(=O)C(C(C)=O)[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CA14 Q9ULX7 1/20 0.31
THRB P10828 1/20 0.31
CYP2C19 P33261 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL405746 0.88 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2CA14CYP2C19KMT2A
SCHEMBL10464095 0.83 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2
SCHEMBL27853893 0.82 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2CA14CYP2C19KMT2A
SCHEMBL18643781 0.80
SCHEMBL5404644 0.80 ALDH1A1 (0.38) ALDH1A1
SCHEMBL21578228 0.78 SMN1; SMN2 (0.35) ALDH1A1SMN1; SMN2CA14MEN1KMT2A
SCHEMBL6701923 0.78 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2
SCHEMBL16209947 0.74 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11418641 0.73 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2CA14CYP2C19KMT2A
SCHEMBL17089318 0.73 CA5A (0.35) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12258349-B2 Anti-viral drug DORING INTERNATIONAL GMBH (CH) 2025-03-25 US disclosed
EP-3419627-B1 PROCESS FOR THE MANUFACTURE OF ANTIVIRAL COMPOUNDS, SUCH AS TRIAZAVIRIN DORING INT GMBH (CH) 2023-07-12 EP disclosed
EP-3419627-B1 PROCESS FOR THE MANUFACTURE OF ANTIVIRAL COMPOUNDS, SUCH AS TRIAZAVIRIN DORING INT GMBH (CH) 2023-07-12 EP disclosed
US-20220298164-A1 ANTI-VIRAL DRUG DORING INTERNATIONAL GMBH (CN) 2022-09-22 US disclosed
US-11370797-B2 Anti-viral drug DORING INTERNATIONAL GMBH (CH) 2022-06-28 US disclosed
US-20200325143-A1 ANTI-VIRAL DRUG DORING INTERNATIONAL GMBH (CH) 2020-10-15 US disclosed
US-20190055256-A1 ANTI-VIRAL DRUG DORING INTERNATIONAL GMBH (CH) 2019-02-21 US disclosed
EP-3419627-A2 ANTI-VIRAL DRUG Doring International GmbH (CH) 2019-01-02 EP disclosed
WO-2017144709-A1 ANTI-VIRAL DRUG DORING INTERNATIONAL GMBH (CH) 2017-08-31 WO disclosed
WO-2017144708-A2 ANTI-VIRAL DRUG DORING INTERNATIONAL GMBH (CH) 2017-08-31 WO disclosed
WO-2017144708-A2 ANTI-VIRAL DRUG DORING INTERNATIONAL GMBH (CH) 2017-08-31 WO disclosed
US-8835470-B2 Mandelamide heterocyclic compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-16 US disclosed
US-8404672-B2 Substituted heterocyclic compounds BRISTOL-MEYERS SQUIBB COMPANY (US) 2013-03-26 US disclosed
US-8399451-B2 Heterocyclic compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2013-03-19 US disclosed
US-20130045964-A1 MANDELAMIDE HETEROCYCLIC COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2013-02-21 US disclosed
US-8354398-B2 Substituted isoxazole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-15 US disclosed
US-20120022041-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-01-26 US disclosed
US-20110300165-A1 SUBSTITUTED ISOXAZOLE COMPOUNDS The Board of TRustees of the University of Illinoi University of Illinios (US) 2011-12-08 US disclosed
US-20110190255-A1 HETEROCYCLIC COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2011-08-04 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 (9 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-20220298164-A1 ANTI-VIRAL DRUG ZC3HAV1, ZC3HAV1L, SARS1 ALDH1A1 1309/4885SMN1; SMN2 2218/4885CA14 885/4885
US-11370797-B2 Anti-viral drug NSUN3, EIF2AK2, NSUN2 ALDH1A1 1794/4885SMN1; SMN2 498/4885CA14 3687/4885
US-20200325143-A1 ANTI-VIRAL DRUG NSUN3, EIF2AK2, NSUN2 ALDH1A1 1794/4885SMN1; SMN2 498/4885CA14 3687/4885
US-20110190255-A1 HETEROCYCLIC COMPOUNDS S1PR1, S1PR3, S1PR5 ALDH1A1 3119/4885SMN1; SMN2 1771/4885CA14 4832/4885
US-20190055256-A1 ANTI-VIRAL DRUG EIF2AK2, NSUN3, NSUN2 ALDH1A1 1485/4885SMN1; SMN2 332/4885CA14 4446/4885
US-20110300165-A1 SUBSTITUTED ISOXAZOLE COMPOUNDS S1PR4, S1PR3, S1PR1 ALDH1A1 1558/4885SMN1; SMN2 3484/4885CA14 4182/4885
US-20130045964-A1 MANDELAMIDE HETEROCYCLIC COMPOUNDS S1PR1, S1PR3, S1PR5 ALDH1A1 2189/4885SMN1; SMN2 1302/4885CA14 4611/4885
US-12258349-B2 Anti-viral drug ZC3HAV1, ZC3HAV1L, SARS1 ALDH1A1 1309/4885SMN1; SMN2 2218/4885CA14 885/4885
US-20120022041-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS S1PR1, S1PR4, S1PR3 ALDH1A1 2144/4885SMN1; SMN2 3076/4885CA14 4153/4885

“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.