SCHEMBL3106340

SCHEMBL3106340

Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NN(C(O)=S)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 2/20 0.53
▸ ALDH1A1 P00352 7/20 0.52
▸ GAA P10253 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ KMT2A Q03164 2/20 0.51
▸ LMNA P02545 2/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.48
▸ GLA P06280 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ TSHR P16473 2/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ GHSR Q92847 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MEN1 O00255 1/20 0.45

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
SCHEMBL3267048 0.87 ALDH1A1 (0.52) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL7173488 0.77 ALDH1A1 (0.66) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL3106332 0.76 ALDH1A1 (0.54) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL1225498 0.74 PTGS2 (0.67) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL3106329 0.74 ALDH1A1 (0.56) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL3992403 0.71 MAPT (0.50) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL3637872 0.70 GHSR (0.80) PTGS2GHSR
SCHEMBL7058846 0.69 TSHR (0.72) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL1224858 0.69 ALDH1A1 (1.00) PTGS2ALDH1A1GAAMAPTKDM4E
SCHEMBL8722346 0.68 ALDH1A1 (0.75) PTGS2ALDH1A1GAAMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050096372-A1 Small-molecule modulators of hepatocyte growth factor/scatter factor activities PILLARISETTI SIVARAM (US) 2005-05-05 — — US claimed
US-20030216459-A1 Small-molecule modulators of hepatocyte growth factor / scatter factor activities THE FEINSTEIN INSTITUTES FOR MEDICAL RESEARCH 2003-11-20 — — US claimed
US-20030045559-A1 Small-molecule modulators of hepatocyte growth factor / scatter factor activities NORTH SHORE-LONG ISLAND JEWISH HEALTH SYSTEM 2003-03-06 — — US claimed
US-8193177-B2 Hepatocyte growth factor pathway activators in fibrotic connective tissue diseases ANGION BIOMEDICA CORP. (US) 2012-06-05 — — US disclosed
US-20100256117-A1 HEPATOCYTE GROWTH FACTOR PATHWAY ACTIVATORS IN FIBROTIC CONNECTIVE TISSUE DISEASES ANGION BIOMEDICA CORP. 2010-10-07 — — US disclosed
WO-2009064422-A2 HEPATOCYTE GROWTH FACTOR PATHWAY ACTIVATORS IN FIBROTIC CONNECTIVE TISSUE DISEASES ANGION BIOMEDICA CORP. (US) 2009-05-22 — — WO disclosed
US-20050096372-A1 Small-molecule modulators of hepatocyte growth factor/scatter factor activities PILLARISETTI SIVARAM (US) 2005-05-05 — — US disclosed
US-6855728-B2 Small-molecule modulators of hepatocyte growth factor / scatter factor activities NORTH SHORE-LONG ISLAND JEWISH HEALTH SYSTEM (US) 2005-02-15 — — US disclosed
US-20030216459-A1 Small-molecule modulators of hepatocyte growth factor / scatter factor activities THE FEINSTEIN INSTITUTES FOR MEDICAL RESEARCH 2003-11-20 — — 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 (4 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-20030045559-A1 Small-molecule modulators of hepatocyte growth factor / scatter factor activities HGF, HDGF, MET PTGS2 361/4885ALDH1A1 510/4885GAA 2947/4885
US-20030216459-A1 Small-molecule modulators of hepatocyte growth factor / scatter factor activities HGF, HDGF, MET PTGS2 361/4885ALDH1A1 510/4885GAA 2947/4885
US-20050096372-A1 Small-molecule modulators of hepatocyte growth factor/scatter factor activities HGF, HDGF, MET PTGS2 361/4885ALDH1A1 510/4885GAA 2947/4885
US-20100256117-A1 HEPATOCYTE GROWTH FACTOR PATHWAY ACTIVATORS IN FIBROTIC CONNECTIVE TISSUE DISEASES HGF, HDGF, HGFAC PTGS2 1483/4885ALDH1A1 1992/4885GAA 3118/4885

“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.

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