SCHEMBL8894811

SCHEMBL8894811

NCCN[C@@H](CO)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 1/20 0.44
TGFBR1 P36897 1/20 0.38
CPB2 Q96IY4 5/20 0.33
CPB1 P15086 1/20 0.31

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
SCHEMBL8894803 1.00 GGT1 (0.44) GGT1TGFBR1CPB2CPB1
SCHEMBL10724429 0.84 GGT1 (0.46) GGT1CPB2CPB1
SCHEMBL28581575 0.82 GGT1 (0.58) GGT1TGFBR1CPB2CPB1
SCHEMBL880551 0.82 GGT1 (0.58) GGT1TGFBR1CPB2CPB1
SCHEMBL21206958 0.80 TGFBR1 (0.36) TGFBR1
SCHEMBL4759293 0.80 GGT1 (0.43) GGT1CPB2CPB1
SCHEMBL27902177 0.78 GGT1 (0.46) GGT1CPB2CPB1
SCHEMBL16382140 0.77 GGT1 (0.41) GGT1TGFBR1CPB2CPB1
SCHEMBL9802585 0.75 EPHX1 (0.41)
SCHEMBL3095619 0.75 ANPEP (0.35) TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5681543-A Polymer-bonded complexing agents and pharmaceutical agents containing them for MRI SHERING AKTIENGESELLSCHAFT (DE) 1997-10-28 US disclosed
US-5681544-A Polymer-bonded complexing agents, their complexes and conjugates, processes for their production and pharmaceutical agents containing them SCHERING AKTIENGESELLSCHAFT (DE) 1997-10-28 US disclosed
US-5482700-A Substituted polyamino, polycarboxy complexing agent dimers for MRI and X-ray contrast SCHERING AKTIENGESELLSCHAFT (DE) 1996-01-09 US disclosed
EP-0331616-B1 Polymer-bonded complexe builders, their complexes, process for their preparation and pharmaceutical agents containing the same SCHERING AG (DE) 1995-11-08 EP disclosed
EP-0305320-B1 MULTINUCLEIC SUBSTITUTED COMPLEXANTS, COMPLEXES AND COMPLEX SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL AGENTS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1992-09-23 EP disclosed
EP-0357622-A1 SUBSTITUTED COMPLEX-FORMING SUBSTANCES, COMPLEXES AND COMPLEX SALTS, PROCESS FOR MANUFACTURE THEREOF AND PHARMACEUTICAL AGENTS WHICH CONTAIN THEM SCHERING AKTIENGESELLSCHAFT (DE) 1990-03-14 EP disclosed
EP-0355097-A1 SUBSTITUTED CYCLIC COMPLEX-FORMING SUBSTANCES, COMPLEXES AND COMPLEX SALTS, PROCESS FOR MANUFACTURING SAME, AND PHARMACEUTICAL AGENTS WHICH CONTAIN THEM SCHERING AKTIENGESELLSCHAFT (DE) 1990-02-28 EP disclosed
EP-0331616-A2 Polymer-bonded complexe builders, their complexes, process for their preparation and pharmaceutical agents containing the same SCHERING AKTIENGESELLSCHAFT (DE) 1989-09-06 EP disclosed
EP-0305320-A2 Multinucleic substituted complexants, complexes and complex salts, process for their preparation and pharmaceutical agents containing them SCHERING AKTIENGESELLSCHAFT (DE) 1989-03-01 EP disclosed
WO-1988008422-A1 SUBSTITUTED CYCLIC COMPLEX-FORMING SUBSTANCES, COMPLEXES AND COMPLEX SALTS, PROCESS FOR MANUFACTURING SAME, AND PHARMACEUTICAL AGENTS WHICH CONTAIN THEM SCHERING AKTIENGESELLSCHAFT (DE) 1988-11-03 WO disclosed
WO-1988007521-A1 SUBSTITUTED COMPLEX-FORMING SUBSTANCES, COMPLEXES AND COMPLEX SALTS, PROCESS FOR MANUFACTURE THEREOF AND PHARMACEUTICAL AGENTS WHICH CONTAIN THEM SCHERING AKTIENGESELLSCHAFT (DE) 1988-10-06 WO disclosed