SCHEMBL8798752

SCHEMBL8798752

CCOC(=O)C(CCCC1CCCCC1)(CCC(N)C(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.40
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
METAP1 P53582 1/20 0.33
MMP2 P08253 1/20 0.32
BMP1 P13497 1/20 0.32
EPHX1 P07099 1/20 0.32
FKBP1A P62942 3/20 0.32
NAAA Q02083 3/20 0.31
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL8327502 0.95 METAP2 (0.39) METAP2CTSSCTSKMETAP1MMP2
SCHEMBL8323683 0.89 METAP2 (0.39) METAP2CTSSCTSKMETAP1
Potassium Ion SCHEMBL8798428 0.86 METAP2 (0.36) METAP2CTSSCTSKMETAP1EPHX1
SCHEMBL8328926 0.85 METAP2 (0.38) METAP2CTSSCTSKMETAP1
SCHEMBL8798969 0.82 CASP1 (0.34) METAP2CTSSCTSKEPHX1FKBP1A
SCHEMBL8331769 0.80 EPHX1 (0.44) METAP2CTSSCTSKEPHX1
SCHEMBL8800052 0.78 METAP2 (0.38) METAP2METAP1
SCHEMBL8329953 0.76 METAP2 (0.37) METAP2CTSSCTSKEPHX1
SCHEMBL8800115 0.76 METAP2 (0.37) METAP2CTSSCTSKEPHX1
SCHEMBL8798756 0.75 METAP2 (0.36) METAP2CTSSCTSKMMP2BMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792878-A2 Geminal carboxylic acids and esters thereof, pharmaceutical formulations containing them useful in the treatment of bone dysmetabolism Dompé S.P.A. (IT) 1997-09-03 EP disclosed