SCHEMBL3992403

SCHEMBL3992403

Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NN(C)c1ccc([N+](=O)[O-])cn1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ NPSR1 Q6W5P4 3/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ PTGS2 P35354 4/20 0.49
▸ TDP1 Q9NUW8 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ GAA P10253 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ GHSR Q92847 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ TSHR P16473 2/20 0.47
▸ LMNA P02545 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GPBAR1 Q8TDU6 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
SCHEMBL1225498 0.77 PTGS2 (0.67) MAPTALDH1A1NPSR1L3MBTL1PTGS2
SCHEMBL3106340 0.71 PTGS2 (0.53) MAPTALDH1A1NPSR1L3MBTL1PTGS2
SCHEMBL7058846 0.70 TSHR (0.72) MAPTALDH1A1NPSR1L3MBTL1PTGS2
SCHEMBL7173488 0.69 ALDH1A1 (0.66) MAPTALDH1A1NPSR1L3MBTL1PTGS2
SCHEMBL3554810 0.68 GPBAR1 (0.72) MAPTALDH1A1L3MBTL1PTGS2TDP1
SCHEMBL1225653 0.67 KMT2A (0.66) MAPTALDH1A1NPSR1L3MBTL1TDP1
SCHEMBL1224417 0.67 ALDH1A1 (0.77) MAPTALDH1A1NPSR1L3MBTL1PTGS2
SCHEMBL3106329 0.67 ALDH1A1 (0.56) MAPTALDH1A1NPSR1L3MBTL1PTGS2
SCHEMBL316185 0.67 ALDH1A1 (0.76) MAPTALDH1A1NPSR1L3MBTL1PTGS2
SCHEMBL3451560 0.67 TSHR (0.75) MAPTALDH1A1NPSR1L3MBTL1PTGS2

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
EP-1355921-A2 MODULATORS OF CELLULAR PROLIFERATION AND ANGIOGENESIS, METHODS FOR USE AND IDENTIFICATION THEREOF North Shore-Long Island Jewish Health System (US) 2003-10-29 — — EP 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
WO-2002002593-A2 MODULATORS OF CELLULAR PROLIFERATION AND ANGIOGENESIS, METHODS FOR USE AND IDENTIFICATION THEREOF NORTH SHORE-LONG ISLAND JEWISH HEALTH SYSTEM (US) 2002-01-10 — — WO claimed
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 (3 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 MAPT 4612/4885ALDH1A1 510/4885NPSR1 3498/4885
US-20030216459-A1 Small-molecule modulators of hepatocyte growth factor / scatter factor activities HGF, HDGF, MET MAPT 4612/4885ALDH1A1 510/4885NPSR1 3498/4885
US-20050096372-A1 Small-molecule modulators of hepatocyte growth factor/scatter factor activities HGF, HDGF, MET MAPT 4612/4885ALDH1A1 510/4885NPSR1 3498/4885

“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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