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SCHEMBL29666294

SCHEMBL29666294

NCCC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 7/20 0.56
▸ LTA4H P09960 1/20 0.52
▸ MME P08473 1/20 0.51
▸ ERAP2 Q6P179 1/20 0.49
▸ ERAP1 Q9NZ08 1/20 0.49
▸ LNPEP Q9UIQ6 1/20 0.49

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
SCHEMBL29666286 0.98 GHSR (0.59) GHSRLTA4H
SCHEMBL29619338 0.92 GHSR (0.60) GHSR
SCHEMBL29577130 0.92 LTA4H (0.57) GHSRLTA4HMMEERAP2ERAP1
SCHEMBL29577979 0.92 LTA4H (0.57) GHSRLTA4HMMEERAP2ERAP1
SCHEMBL29808394 0.91 GHSR (0.63) GHSR
SCHEMBL29748708 0.91 GHSR (0.61) GHSR
SCHEMBL30506402 0.91 LTA4H (0.58) GHSRLTA4HMMEERAP2ERAP1
SCHEMBL30671563 0.91 LTA4H (0.58) GHSRLTA4HMMEERAP2ERAP1
SCHEMBL30958546 0.91 LTA4H (0.58) GHSRLTA4HMMEERAP2ERAP1
SCHEMBL29666169 0.91 GHSR (0.63) GHSRLTA4HMMEERAP2ERAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114634554-B Anti-wrinkle cyclic hexapeptide compound and preparation method thereof 浙江湃肽生物股份有限公司 2022-12-06 — — CN disclosed
CN-114634554-A Anti-wrinkle cyclic hexapeptide compound and preparation method thereof 浙江湃肽生物股份有限公司 2022-06-17 — — CN disclosed
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