SCHEMBL31462013

SCHEMBL31462013

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.59
▸ MAPK9 P45984 1/20 0.59
▸ MAPK10 P53779 1/20 0.59
▸ KEAP1 Q14145 1/20 0.58
▸ REN P00797 1/20 0.51
▸ NMUR2 Q9GZQ4 3/20 0.49
▸ NMUR1 Q9HB89 3/20 0.49
▸ RXFP3 Q9NSD7 6/20 0.49
▸ RXFP4 Q8TDU9 4/20 0.49
▸ PTH1R Q03431 2/20 0.49
▸ BECN1 Q14457 2/20 0.48

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
SCHEMBL31462011 0.98 MAPK8 (0.59) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL29608097 0.92 MAPK8 (0.61) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL30726561 0.91 KEAP1 (0.68) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL30906421 0.91 KEAP1 (0.68) MAPK8MAPK9MAPK10KEAP1RXFP3
SCHEMBL30906447 0.89 KEAP1 (0.66) MAPK8MAPK9MAPK10KEAP1PTH1R
SCHEMBL29607025 0.89 MAPK8 (0.63) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL30906548 0.89 KEAP1 (0.72) MAPK8MAPK9MAPK10KEAP1PTH1R
SCHEMBL30906522 0.88 MAPK8 (0.67) MAPK8MAPK9MAPK10KEAP1PTH1R
SCHEMBL31461931 0.88 REN (0.56) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL29679527 0.87 MAPK8 (0.66) MAPK8MAPK9MAPK10KEAP1PTH1R

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-20250113828-A1 METHOD OF USING/APPLYING A KERATIN HYDROLYSIS PEPTIDE SOLUTION TO IMPROVE THE FERTILIZER USAGE EFFICIENCY IN COTTON CH BIOTECH R&D CO., LTD. (TW) 2025-04-10 — — US disclosed
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