SCHEMBL9469887

SCHEMBL9469887

COCCC(CC1(C(=O)N[C@H]2CC[C@@H](C(=O)OCc3ccccc3)CC2)CCCC1)C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MME P08473 14/20 0.52
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.41
EPHX1 P07099 1/20 0.37

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
SCHEMBL9469892 1.00 MME (0.52) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469610 0.89 MME (0.60) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469613 0.89 MME (0.60) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469305 0.89 MME (0.45) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469492 0.89 MME (0.45) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469567 0.89 MME (0.45) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469571 0.89 MME (0.45) MMEALDH1A1GAATSHREPHX1
SCHEMBL9470555 0.88 MME (0.48) MMEALDH1A1GAATSHREPHX1
SCHEMBL9470542 0.88 MME (0.48) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469953 0.87 MME (0.44) MMEALDH1A1GAATSHREPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0274234-A2 Spiro-subsituted glutaramide diuretic agents Pfizer Limited (GB) 1988-07-13 EP disclosed