SCHEMBL5656233

SCHEMBL5656233

CCOc1ccccc1NC(=O)OCCN1CCN(c2cccc([N+](=O)[O-])c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
ALDH1A1 P00352 2/20 0.50
NPC1 O15118 2/20 0.47
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
ENPP2 Q13822 1/20 0.47
GFER P55789 1/20 0.46
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL5657975 0.87 MAPT (0.59) KMT2AMEN1ALDH1A1NPC1LMNA
SCHEMBL14457597 0.86 DRD2 (0.52) KMT2AMEN1ALDH1A1NPC1DRD2
SCHEMBL5656137 0.86 NPC1 (0.51) KMT2AMEN1ALDH1A1NPC1LMNA
SCHEMBL5657782 0.86 KMT2A (0.63) KMT2AMEN1NPC1LMNAL3MBTL1
SCHEMBL5657841 0.86 HTR1A (0.55) KMT2AMEN1NPC1LMNAMAPT
SCHEMBL5656207 0.85 NPC1 (0.65) KMT2AMEN1ALDH1A1NPC1DRD2
SCHEMBL6414969 0.85 POLB (0.49) KMT2AMEN1ALDH1A1NPC1LMNA
SCHEMBL6176786 0.84 POLB (0.51) KMT2AMEN1ALDH1A1NPC1LMNA
SCHEMBL6419494 0.84 POLB (0.50) KMT2AMEN1ALDH1A1NPC1DRD2
SCHEMBL6414971 0.84 POLB (0.50) KMT2AMEN1ALDH1A1NPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238693-B2 Aryl carbamate derivatives, preparation and use thereof CEREP (FR) 2007-07-03 US disclosed
US-20050267126-A1 Compounds derived from aryl carbamates, preparation thereof and uses of same CEREP (FR) 2005-12-01 US disclosed
EP-1530564-A2 COMPOUNDS DERIVED FROM ARYL CARBAMATES, PREPARATION THEREOF AND USES OF SAME Cerep (FR) 2005-05-18 EP disclosed
US-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof CEREP (FR) 2004-03-25 US disclosed
WO-2004018436-A2 COMPOUNDS DERIVED FROM ARYL CARBAMATES, PREPARATION THEREOF AND USES OF SAME CEREP (FR) 2004-03-04 WO disclosed
EP-1362041-A1 ARYL CARBAMATE DERIVATIVES, PREPARATION AND USE THEREOF Cerep (FR) 2003-11-19 EP disclosed
WO-2002068399-A1 ARYL CARBAMATE DERIVATIVES, PREPARATION AND USE THEREOF CEREP (FR) 2002-09-06 WO 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-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof HTR4, HTR5A, HTR3C KMT2A 2124/4885MEN1 3474/4885ALDH1A1 1018/4885
US-20050267126-A1 Compounds derived from aryl carbamates, preparation thereof and uses of same HTR4, HTR2B, HTR1B KMT2A 1571/4885MEN1 3108/4885ALDH1A1 707/4885

“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.