SCHEMBL5709586

SCHEMBL5709586

CC(C)C[C@H](O)[C@H](OC(=O)C(F)(F)F)[C@@H](N)CC1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.44
METAP2 P50579 5/20 0.36
METAP1 P53582 3/20 0.36
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSH P09668 1/20 0.34
CTSK P43235 1/20 0.34

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
SCHEMBL5709584 0.83 REN (0.41) RENMETAP2METAP1CTSLCTSB
SCHEMBL7339021 0.83 REN (0.40) RENMETAP2METAP1CTSLCTSB
SCHEMBL7333758 0.83 REN (0.40) RENMETAP2METAP1CTSLCTSB
SCHEMBL9437488 0.83 REN (0.40) RENMETAP2METAP1CTSLCTSB
SCHEMBL10767496 0.80 REN (0.42) RENMETAP2METAP1CTSLCTSB
Trifluoroacetic Acid SCHEMBL5709566 0.79 REN (0.46) RENMETAP2METAP1
SCHEMBL7331754 0.79 REN (0.44) RENMETAP2METAP1
SCHEMBL7331477 0.77 REN (0.42) RENMETAP2METAP1
SCHEMBL7333234 0.77 REN (0.39) RENMETAP2METAP1CTSLCTSB
SCHEMBL7279876 0.75 REN (0.55) RENMETAP2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1712227-A1 Amino diols useful in the treatment of Alzheimer's disease Elan Pharmaceuticals, Inc. (US) 2006-10-18 EP claimed
US-20050080141-A1 Amino diols useful in the treatment of alzheimer's disease SCHOSTAREZ HEINRICH J (US) 2005-04-14 US claimed
US-5229369-A Aminoalkylaminocarbonyl aminodiol amino acid derivatives as anti-hypertensive agents G. D. SEARLE & CO. (US) 1993-07-20 US claimed
WO-1990000050-A1 AMINOALKYLAMINOCARBONYL AMINODIOL AMINO ACID DERIVATIVES AS ANTI-HYPERTENSIVE AGENTS G.D. SEARLE & CO. (US) 1990-01-11 WO claimed
EP-0349922-A2 Aminoalkylaminocarbonyl aminodiol amino acid derivatives as anti-hypertensive agents G.D. Searle & Co. (US) 1990-01-10 EP claimed
EP-1712227-A1 Amino diols useful in the treatment of Alzheimer's disease Elan Pharmaceuticals, Inc. (US) 2006-10-18 EP disclosed
US-20050080141-A1 Amino diols useful in the treatment of alzheimer's disease SCHOSTAREZ HEINRICH J (US) 2005-04-14 US disclosed
US-5229369-A Aminoalkylaminocarbonyl aminodiol amino acid derivatives as anti-hypertensive agents G. D. SEARLE & CO. (US) 1993-07-20 US disclosed
WO-1993002667-A1 PHARMACEUTICAL COMPOSITION ABBOTT LABORATORIES (US) 1993-02-18 WO disclosed
WO-1990000050-A1 AMINOALKYLAMINOCARBONYL AMINODIOL AMINO ACID DERIVATIVES AS ANTI-HYPERTENSIVE AGENTS G.D. SEARLE & CO. (US) 1990-01-11 WO disclosed
EP-0349922-A2 Aminoalkylaminocarbonyl aminodiol amino acid derivatives as anti-hypertensive agents G.D. Searle & Co. (US) 1990-01-10 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-20050080141-A1 Amino diols useful in the treatment of alzheimer's disease BACE1, BACE2, APP REN 2199/4885METAP2 55/4885METAP1 36/4885

“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.