SCHEMBL11301401

SCHEMBL11301401

CCNCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)P(=O)(O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
ANPEP P15144 1/20 0.31
TERT O14746 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
SCHEMBL11297720 0.88 ANPEP (0.38) MMP1MMP2MMP3ANPEP
SCHEMBL11296860 0.84 ANPEP (0.32) MMP1MMP2MMP3ANPEP
SCHEMBL11299593 0.83 S1PR2 (0.44) ANPEP
SCHEMBL11306049 0.82 KDM4E (0.32)
SCHEMBL11307612 0.82 ANPEP (0.32) MMP1MMP2MMP3ANPEP
SCHEMBL11303958 0.80
SCHEMBL1582657 0.79 CTSC (0.40) MMP1MMP2MMP3ANPEP
SCHEMBL11298100 0.78 MEN1 (0.44) MMP1MMP3ANPEP
SCHEMBL11303917 0.78 DPP7 (0.34) MMP2ANPEP
SCHEMBL1582304 0.77 CTSC (0.34) ANPEPTERT

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
EP-0026409-A1 Combinations of active ingredients, pharmaceutical preparations, as well as their preparation F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-04-08 EP disclosed
US-4250085-A PHOSPHONATE-CONTAINING OLIGOPEPTIDES, BACTERICIDES HOFFMANN-LA ROCHE INC. (US) 1981-02-10 US disclosed