SCHEMBL9475212

SCHEMBL9475212

CCCCCC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 10/20 0.59
ACE P12821 8/20 0.56
PRCP P42785 1/20 0.56
ACE2 Q9BYF1 4/20 0.54

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
SCHEMBL9094520 0.99 FKBP1A (0.58) FKBP1AACEPRCPACE2
SCHEMBL6786208 0.94 FKBP1A (0.62) FKBP1AACE
SCHEMBL6786218 0.94 FKBP1A (0.62) FKBP1AACE
SCHEMBL6787342 0.94 FKBP1A (0.62) FKBP1AACE
SCHEMBL6882459 0.93 FKBP1A (0.59) FKBP1AACE
SCHEMBL5491445 0.93 FKBP1A (0.59) FKBP1AACE
SCHEMBL5491454 0.93 FKBP1A (0.59) FKBP1AACE
SCHEMBL6784258 0.93 FKBP1A (0.61) FKBP1AACEPRCP
SCHEMBL6784238 0.93 FKBP1A (0.61) FKBP1AACEPRCP
SCHEMBL6793612 0.92 FKBP1A (0.62) FKBP1AACEACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109081789-A The positive positive hexanoyl fatty acid/amino acid of hexanoyl amino first cyclic amide base of amino, synthesis, activity and application 首都医科大学 2018-12-25 CN disclosed
US-5204462-A Strong serine protease inhibiting effect JAPAN TOBACCO, INC. (JP) 1993-04-20 US disclosed
EP-0480044-A1 NOVEL 4H-3,1-BENZOXAZIN-4-ONE DERIVATIVE Japan Tobacco Inc. (JP) 1992-04-15 EP disclosed