SCHEMBL4540136

SCHEMBL4540136

CC1CNC(=O)C(C)N1C(=O)OCc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.71
CACNA1G O43497 1/20 0.55
CACNA1H O95180 1/20 0.55
CACNA1I Q9P0X4 1/20 0.55
GLA P06280 1/20 0.47
HCRTR2 O43614 1/20 0.46
NAAA Q02083 1/20 0.45
PSEN1 P49768 1/20 0.45
PSEN2 P49810 1/20 0.45
APH1B Q8WW43 1/20 0.45
NCSTN Q92542 1/20 0.45
APH1A Q96BI3 1/20 0.45
PSENEN Q9NZ42 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
PARP1 P09874 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL4388003 1.00 HTR2C (0.71) HTR2CCACNA1GCACNA1HCACNA1IGLA
SCHEMBL4388000 1.00 HTR2C (0.71) HTR2CCACNA1GCACNA1HCACNA1IGLA
SCHEMBL25807854 0.83 HTR2C (1.00) HTR2CCACNA1GCACNA1HCACNA1IGLA
SCHEMBL4677060 0.83 HTR2C (1.00) HTR2CCACNA1GCACNA1HCACNA1IGLA
SCHEMBL4677056 0.83 HTR2C (1.00) HTR2CCACNA1GCACNA1HCACNA1IGLA
Hydrochloric Acid SCHEMBL4681156 0.82 HTR2C (0.97) HTR2CCACNA1GCACNA1HCACNA1IGLA
Hydrochloric Acid SCHEMBL4681160 0.82 HTR2C (0.97) HTR2CCACNA1GCACNA1HCACNA1IGLA
SCHEMBL25635525 0.81 HTR2C (0.63) HTR2CCACNA1GCACNA1HCACNA1IHCRTR2
SCHEMBL2391021 0.81 HTR2C (0.63) HTR2CCACNA1GCACNA1HCACNA1IHCRTR2
SCHEMBL14750028 0.81 HTR2C (0.63) HTR2CCACNA1GCACNA1HCACNA1IGLA

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-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US disclosed
EP-1051176-A4 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARM PROD INC (US) 2002-06-12 EP disclosed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
CN-1291892-A Substituted oxoazaheterocyclyl factor Xa inhibitors AWENTIS PHARMACEUTICAL INC (US) 2001-04-18 CN disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO disclosed
EP-1051176-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2000-11-15 EP disclosed
WO-2000032590-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-08 WO disclosed
WO-1999037304-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-07-29 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 (1 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-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 HTR2C 1330/4885CACNA1G 3668/4885CACNA1H 3316/4885

“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.