SCHEMBL8328592

SCHEMBL8328592

CCOC(=O)C(CCCN(C(=O)OC(C)(C)C)C(C)C)(CC1CCCCC1)C(=O)OCC

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
METAP2 P50579 1/20 0.32

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
SCHEMBL8332092 0.81 NFKB1 (0.33) NFKB1NFKB2RELAMETAP2
SCHEMBL11005384 0.77 CYP1A2 (0.42) METAP2
SCHEMBL8332090 0.76 METAP2 (0.38) METAP2
SCHEMBL8328919 0.76 EPHX1 (0.46) METAP2
SCHEMBL8328587 0.76 EPHX1 (0.33) METAP2
SCHEMBL8327178 0.76 BCHE (0.39) METAP2
SCHEMBL8328926 0.75 METAP2 (0.38) METAP2
SCHEMBL8331541 0.75 SIGMAR1 (0.38) METAP2
SCHEMBL8328594 0.75 REN (0.39) METAP2
SCHEMBL8329946 0.75 EPHX1 (0.49) METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5908863-A ANTIGROWTH AGENT FOR BONES DOMPE' S.P.A. (IT) 1999-06-01 US disclosed
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