SCHEMBL9470310

SCHEMBL9470310

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

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MME P08473 8/20 0.45
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.43
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
EPHX1 P07099 1/20 0.36
DPP4 P27487 2/20 0.36
DPP7 Q9UHL4 2/20 0.36
NAMPT P43490 1/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL9470317 1.00 MME (0.45) MMEALDH1A1GAATSHRCA1
SCHEMBL10694092 0.94 MME (0.52) MMEALDH1A1GAATSHR
SCHEMBL10694097 0.94 MME (0.52) MMEALDH1A1GAATSHR
SCHEMBL6938276 0.84 MME (0.57) MMEALDH1A1GAATSHR
SCHEMBL6938274 0.84 MME (0.57) MMEALDH1A1GAATSHR
SCHEMBL9469887 0.82 MME (0.52) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469892 0.82 MME (0.52) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469305 0.81 MME (0.45) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469492 0.81 MME (0.45) MMEALDH1A1GAATSHREPHX1
SCHEMBL9469567 0.81 MME (0.45) 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 3 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