SCHEMBL9470085

SCHEMBL9470085

CCOC(=O)[C@@H]1CCC[C@H](NC(=O)C2(CC(COCCOC)C(=O)O)CCCC2)C1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MME P08473 15/20 0.68
EPHX2 P34913 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9470089 1.00 MME (0.68) MMEEPHX2SMN1; SMN2
SCHEMBL9470086 1.00 MME (0.68) MMEEPHX2SMN1; SMN2
Water SCHEMBL9469360 0.90 MME (0.79) MME
Water SCHEMBL9469358 0.90 MME (0.79) MME
SCHEMBL9469563 0.89 MME (0.81) MMEEPHX2
SCHEMBL9469559 0.89 MME (0.81) MMEEPHX2
SCHEMBL9469562 0.89 MME (0.81) MMEEPHX2
SCHEMBL7449192 0.85 MME (0.84) MMEEPHX2SMN1; SMN2
SCHEMBL9470364 0.84 MME (0.73) MME
SCHEMBL9470361 0.84 MME (0.73) MME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274234-B1 SPIRO-SUBSITUTED GLUTARAMIDE DIURETIC AGENTS Pfizer Limited (GB) 1991-09-11 EP claimed
EP-0274234-A2 Spiro-subsituted glutaramide diuretic agents Pfizer Limited (GB) 1988-07-13 EP claimed
US-5192800-A Hypotensive agents PFIZER INC. (US) 1993-03-09 US disclosed
EP-0274234-B1 SPIRO-SUBSITUTED GLUTARAMIDE DIURETIC AGENTS Pfizer Limited (GB) 1991-09-11 EP disclosed
US-5030654-A Glutaramide diuretic agents PFIZER INC. (US) 1991-07-09 US disclosed