SCHEMBL28656948

SCHEMBL28656948

N=C(N)NCCCC(CNC(CC1CCCC1)C(=O)NC(CCCCN)C(N)=O)NC(=O)C(N)CC1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NMT1 P30419 4/20 0.42
▸ NMT2 O60551 3/20 0.42
▸ CPB2 Q96IY4 11/20 0.42
▸ NPY4R P50391 3/20 0.39
▸ NPY1R P25929 2/20 0.39
▸ NPY2R P49146 2/20 0.39
▸ NPY5R Q15761 2/20 0.39

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
SCHEMBL28656946 1.00 NMT1 (0.42) NMT1NMT2CPB2NPY4RNPY1R
SCHEMBL28645725 0.99 NMT1 (0.44) NMT1NMT2CPB2
SCHEMBL28645728 0.99 NMT1 (0.44) NMT1NMT2CPB2
SCHEMBL22117473 0.91 NMT1 (0.48) NMT1NMT2CPB2NPY4RNPY1R
SCHEMBL22117472 0.91 NMT1 (0.48) NMT1NMT2CPB2NPY4RNPY1R
SCHEMBL22117559 0.90 NMT1 (0.50) NMT1NMT2CPB2NPY4R
SCHEMBL22117561 0.90 NMT1 (0.50) NMT1NMT2CPB2NPY4R
SCHEMBL28652449 0.89 NPY4R (0.46) CPB2NPY4RNPY1RNPY2RNPY5R
SCHEMBL28652444 0.89 NPY4R (0.46) CPB2NPY4RNPY1RNPY2RNPY5R
SCHEMBL28637452 0.89 OPRM1 (0.45) CPB2NPY4RNPY1RNPY2RNPY5R

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-113544138-A Mitochondrial targeting peptides 隐形生物治疗公司 2021-10-22 — — CN disclosed
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