SCHEMBL9312415

SCHEMBL9312415

NC(=O)C[C@H](NCC=CO)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 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
SCHEMBL757319 0.87 ECE1 (0.38) ECE1
SCHEMBL8350972 0.78 ECE1 (0.36) ECE1
SCHEMBL759010 0.73 KMT2A (0.42)
SCHEMBL27390881 0.73 KMT2A (0.42)
SCHEMBL7034111 0.71 ECE1 (0.42) ECE1
SCHEMBL3856802 0.71 ECE1 (0.42) ECE1
SCHEMBL11499007 0.71 CA2 (0.38)
SCHEMBL3441239 0.69 ECE1 (0.38) ECE1
SCHEMBL1221420 0.69 ECE1 (0.38) ECE1
SCHEMBL4759293 0.69 GGT1 (0.43) ECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5317065-A Poly amino dicarboxylic acid-co-anhydro amino dicarboxylic acid derivative HOECHST AKTIENGESELLSCHAFT (DE) 1994-05-31 US disclosed
US-5229469-A Time-release agents; drug delivery; matrices; materials handling; nontoxic HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-20 US disclosed