SCHEMBL8990461

SCHEMBL8990461

C=CC(=O)CN[C@@H](C)C(=O)O.[NaH]

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MME P08473 1/20 0.34
ACE P12821 1/20 0.34
CPA1 P15085 1/20 0.34
ACE2 Q9BYF1 1/20 0.34
FAAH O00519 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SLC6A5 Q9Y345 1/20 0.31
MAPT P10636 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
SCHEMBL8990457 1.00 TSHR (0.38) TSHRALDH1A1MMEACECPA1
SCHEMBL541433 0.98 TSHR (0.39) TSHRALDH1A1MMEACECPA1
SCHEMBL541431 0.98 TSHR (0.39) TSHRALDH1A1MMEACECPA1
SCHEMBL10596065 0.78 TSHR (0.38) TSHRALDH1A1MMEACECPA1
SCHEMBL1700840 0.73 ALDH1A1 (0.43) ALDH1A1MMEACECPA1ACE2
SCHEMBL2132525 0.73 ALDH1A1 (0.43) ALDH1A1MMEACECPA1ACE2
SCHEMBL2805307 0.73 ALDH1A1 (0.43) ALDH1A1MMEACECPA1ACE2
SCHEMBL253527 0.72
SCHEMBL725364 0.72
SCHEMBL905194 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0392735-B1 Polymeric supports MINNESOTA MINING & MFG (US) 1996-07-17 EP disclosed
US-5403902-A Addition polymerization of water soluble monomers, at least one alkenyl azlactone and crosslinker; useful as complexing agents, supports of chromatography, enzymatic components MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-04-04 US disclosed
US-5336742-A Azlactone-functional polymer supports, e.g. beads; complexing agents, catalysts and biological reagent for proteins and enzymes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-08-09 US disclosed
US-5292840-A Acrylic amide adducts MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-03-08 US disclosed
EP-0354909-B1 VARIABLE CROSSLINKED POLYMERIC SUPPORTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-01-02 EP disclosed
EP-0392735-A2 Polymeric supports MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-10-17 EP disclosed
US-4871824-A AZLACTONE FUNCTIONAL POLYMER BEADS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-10-03 US disclosed
US-4737560-A AZLACTONE FUNCTIONAL MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-04-12 US disclosed