SCHEMBL28067689

SCHEMBL28067689

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 1/20 0.52
▸ REN P00797 12/20 0.52
▸ KMT2A Q03164 1/20 0.51
▸ LNPEP Q9UIQ6 2/20 0.46

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
SCHEMBL28067690 0.82 KMT2A (0.51) KMT2A
SCHEMBL3825215 0.81 CMA1 (0.63) KMT2A
SCHEMBL21748404 0.81 CMA1 (0.63) KMT2A
SCHEMBL3165688 0.81 CMA1 (0.63) KMT2A
SCHEMBL3165695 0.81 CMA1 (0.63) KMT2A
SCHEMBL27210409 0.80 TRHR (0.54) TRHRRENLNPEP
SCHEMBL27210404 0.80 TRHR (0.54) TRHRRENLNPEP
SCHEMBL5689963 0.78 CMA1 (0.54) KMT2A
SCHEMBL31124686 0.78 KMT2A (0.61) KMT2A
SCHEMBL30152222 0.77 CMA1 (0.59) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105622717-A Six cyclic dipeptides used for wound healing GOOD DOCTOR PHARMACEUTICAL GROUP CO LTD 2016-06-01 — — CN disclosed
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