SCHEMBL3561099

SCHEMBL3561099

O=C(O)c1cc([N+](=O)[O-])sn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.35
TDP1 Q9NUW8 3/20 0.34
KDM4E B2RXH2 1/20 0.34
TP53 P04637 1/20 0.34
ALDH1A1 P00352 3/20 0.34
TSHR P16473 4/20 0.33
ALOX15 P16050 3/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
GPR35 Q9HC97 1/20 0.33
LMNA P02545 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CYP3A4 P08684 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
HTT P42858 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
SCHEMBL13155409 0.79 MAPK1 (0.38) KDM4ETP53ALDH1A1MAPTMAPK1
SCHEMBL21722938 0.69
SCHEMBL10400097 0.69
SCHEMBL21722841 0.69 MAPT (0.36) ALDH1A1TSHRALOX15MAPTMAPK1
SCHEMBL11322083 0.69 KDM4E (0.40) TDP1KDM4EALDH1A1TSHRALOX15
SCHEMBL162059 0.69
SCHEMBL162060 0.69
SCHEMBL20928813 0.67
SCHEMBL26103133 0.67
SCHEMBL13954549 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12358906-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors NOVARTIS AG (CH) 2025-07-15 US disclosed
CN-114945571-B Cyclic compounds and methods of use thereof 薛定谔公司 2025-02-25 CN disclosed
US-20240343710-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. 2024-10-17 US disclosed
CN-118666832-A Urea compounds and compositions as SMARCA2/BRM atpase inhibitors 诺华股份有限公司 2024-09-20 CN disclosed
WO-2024178127-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. (US) 2024-08-29 WO disclosed
US-20240270738-A1 UREA COMPOUNDS AND COMPOSITIONS AS SMARCA2/BRM ATPASE INHIBITORS NOVARTIS AG (CH) 2024-08-15 US disclosed
CN-112585136-B Urea compounds and compositions as SMARCA2/BRM atpase inhibitors 诺华股份有限公司 2024-06-25 CN disclosed
US-11958846-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors NOVARTIS AG (CH) 2024-04-16 US disclosed
CN-117779129-A Electronic electroplating rhodium alloy solution, preparation method and electroplating method 昆山一鼎工业科技有限公司 2024-03-29 CN disclosed
US-20240018157-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME SCHRÖDINGER, INC. 2024-01-18 US disclosed
US-20080200465-A1 Substituted with a morpholine group through amido heterocylic groups; interfering with the expression of genes essential for the pathogen's proliferation; treating viral and protozoan infections in mammals GENESOFT PHARMACEUTICALS, INC. (US) 2008-08-21 US disclosed
US-20080200465-A1 Substituted with a morpholine group through amido heterocylic groups; interfering with the expression of genes essential for the pathogen's proliferation; treating viral and protozoan infections in mammals GENESOFT PHARMACEUTICALS, INC. (US) 2008-08-21 US disclosed
US-7348427-B2 Antipathogenic benzamide compounds GENESOFT PHARMACEUTICALS, INC. (US) 2008-03-25 US disclosed
US-7348427-B2 Antipathogenic benzamide compounds GENESOFT PHARMACEUTICALS, INC. (US) 2008-03-25 US disclosed
US-20060205732-A1 Heterocyclic carboxamides and their use as fungicides BAYER SAS (FR) 2006-09-14 US disclosed
US-7084163-B2 Heterocyclic carboxamides and their use as fungicides BAYER CROPSCIENCE S.A. (FR) 2006-08-01 US disclosed
US-20040152698-A1 Heterocyclic carboxamides and their use as fungicides BAYER SAS (FR) 2004-08-05 US disclosed
EP-1425276-A2 HETEROCYCLIC CARBOXAMIDES AND THEIR USE AS FUNGICIDES Bayer CropScience S.A. (FR) 2004-06-09 EP disclosed
WO-2003006454-A2 HETEROCYCLIC CARBOXAMIDES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE S.A. (FR) 2003-01-23 WO disclosed
EP-1275301-A1 Trisubstituted heterocyclic compounds and their use as fungicides Bayer CropScience S.A. (FR) 2003-01-15 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 (8 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-20080200465-A1 Substituted with a morpholine group through amido heterocylic groups; interfering with the expression of genes essential for the pathogen's proliferation; treating viral and protozoan infections in mammals IRF3, BCL3, L3MBTL3 CASP6 949/4885TDP1 4829/4885KDM4E 1943/4885
US-11958846-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors SMARCC1, SMARCC2, SMARCA1 CASP6 3410/4885TDP1 1379/4885KDM4E 1457/4885
US-20040152698-A1 Heterocyclic carboxamides and their use as fungicides CYP1A2, CYP4X1, CYCS CASP6 332/4885TDP1 2440/4885KDM4E 543/4885
US-20240343710-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF PARP1, PARP11, PARP12 CASP6 610/4885TDP1 33/4885KDM4E 1701/4885
US-20060205732-A1 Heterocyclic carboxamides and their use as fungicides CYP4X1, CYP1A2, CYCS CASP6 318/4885TDP1 2646/4885KDM4E 501/4885
US-12358906-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors SMARCC1, SMARCC2, SMARCA1 CASP6 2827/4885TDP1 1618/4885KDM4E 1478/4885
US-20240270738-A1 UREA COMPOUNDS AND COMPOSITIONS AS SMARCA2/BRM ATPASE INHIBITORS SMARCC1, SMARCC2, SMARCA1 CASP6 2756/4885TDP1 1533/4885KDM4E 1382/4885
US-20240018157-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME MALT1, FKBP1B, FKBP1A CASP6 1621/4885TDP1 429/4885KDM4E 3357/4885

“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.