SCHEMBL30440026

SCHEMBL30440026

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.46
▸ MAPK9 P45984 1/20 0.46
▸ MAPK10 P53779 1/20 0.46
▸ KEAP1 Q14145 1/20 0.43
▸ NPY5R Q15761 3/20 0.41
▸ NPY1R P25929 2/20 0.41
▸ NPY4R P50391 2/20 0.41
▸ RAMP3 O60896 11/20 0.40
▸ CALCR P30988 11/20 0.40
▸ NMUR2 Q9GZQ4 2/20 0.39
▸ NMUR1 Q9HB89 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
SCHEMBL31195953 0.97 MAPK8 (0.49) MAPK8MAPK9MAPK10KEAP1NPY5R
SCHEMBL38655078 0.93 MAPK8 (0.48) MAPK8MAPK9MAPK10KEAP1NPY5R
SCHEMBL29687469 0.92 MAPK8 (0.48) MAPK8MAPK9MAPK10KEAP1NPY5R
SCHEMBL29569680 0.92 KEAP1 (0.45) MAPK8MAPK9MAPK10KEAP1RAMP3
SCHEMBL29824904 0.91 MEN1 (0.41) MAPK8MAPK9MAPK10KEAP1NPY5R
SCHEMBL8720811 0.91 MAPK8 (0.44) MAPK8MAPK9MAPK10KEAP1NPY5R
SCHEMBL8720817 0.91 MAPK8 (0.44) MAPK8MAPK9MAPK10KEAP1NPY5R
SCHEMBL29825310 0.90 MAPK8 (0.44) MAPK8MAPK9MAPK10KEAP1NPY5R
SCHEMBL29993959 0.89 MAPK8 (0.52) MAPK8MAPK9MAPK10KEAP1RAMP3
SCHEMBL30039279 0.88 NPY5R (0.47) MAPK8MAPK9MAPK10KEAP1NPY5R

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
US-11613743-B2 Process for the production and purification of the collagenase enzyme from Vibrio alginolyticus FIDIA FARMACEUTICI S.P.A. (IT) 2023-03-28 — — US disclosed
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