SCHEMBL23871532

SCHEMBL23871532

COCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1C[C@@H](O)CN1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 13/20 0.42
▸ CALCR P30988 13/20 0.42
▸ APLNR P35414 2/20 0.42
▸ NAA50 Q9GZZ1 1/20 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
SCHEMBL22018529 0.94 NAA50 (0.44) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018340 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018530 0.94 APLNR (0.43) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018363 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018370 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018314 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018809 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018502 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018810 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2
SCHEMBL22018380 0.94 APLNR (0.48) RAMP3CALCRAPLNRNAA50NMUR2

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
WO-2021191689-A2 TREATMENT OF INFLAMMATORY DISEASES WITH PEPTIDES AND PHARMACEUTICAL COMPOSITIONS YUYU PHARMA, INC. (KR) 2021-09-30 — — WO disclosed
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