SCHEMBL4654530

SCHEMBL4654530

CC(C)C(NC(=O)CCN)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
SDCBP O00560 5/20 0.48
SDC2 P34741 5/20 0.48
NPSR1 Q6W5P4 1/20 0.46
PLA2G2A P14555 1/20 0.45
PLA2G5 P39877 1/20 0.45
EPHX2 P34913 3/20 0.44
MBTPS1 Q14703 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL6445198 1.00 FNTA (0.48) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL6447833 0.90 EPHX2 (0.50) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL6447837 0.90 EPHX2 (0.50) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL15870650 0.87 PLA2G2A (0.53) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL8982548 0.86 MME (0.41) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL10802294 0.86 MME (0.41) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL8982544 0.86 MME (0.41) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL232335 0.83 NPSR1 (0.53) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL15623788 0.83 PLA2G2A (0.56) FNTAFNTBSDCBPSDC2NPSR1
SCHEMBL232334 0.83 NPSR1 (0.53) FNTAFNTBSDCBPSDC2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1991525-A1 CYCLOHEXYLAMINO, BENZENE, PYRIDINE, AND PYRIDAZINE DERIVATIVES Serenex, Inc. (US) 2008-11-19 EP disclosed
WO-2007101156-A1 CYCLOHEXYLAMINO, BENZENE, PYRIDINE, AND PYRIDAZINE DERIVATIVES SERENEX, INC. (US) 2007-09-07 WO disclosed
US-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US disclosed
EP-1392315-A1 METHODS OF TREATING ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
WO-2002100410-A1 METHODS OF TREATING ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP disclosed
EP-0521827-A1 Pharmacological active hydrazin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-01-07 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 (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-20050130941-A1 Methods of treating alzheimer's disease BACE1, PSEN1, BACE2 FNTA 3460/4885FNTB 2741/4885SDCBP 3079/4885

“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.