SCHEMBL29779862

SCHEMBL29779862

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ IL1RN P18510 4/20 0.65
▸ ERAP2 Q6P179 4/20 0.65
▸ GHSR Q92847 1/20 0.61
▸ KISS1R Q969F8 11/20 0.60
▸ ERAP1 Q9NZ08 2/20 0.60
▸ OPRM1 P35372 1/20 0.58
▸ OPRD1 P41143 1/20 0.58

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
SCHEMBL30518155 0.95 IL1RN (0.66) IL1RNERAP2GHSRKISS1RERAP1
SCHEMBL29896929 0.94 GHSR (0.63) ERAP2GHSRERAP1OPRM1OPRD1
SCHEMBL30518838 0.92 ERAP2 (0.61) IL1RNERAP2GHSRKISS1RERAP1
SCHEMBL29508679 0.91 GHSR (0.64) IL1RNERAP2GHSRERAP1
SCHEMBL30788017 0.91 ERAP2 (0.64) IL1RNERAP2GHSRERAP1
SCHEMBL29508662 0.91 GHSR (0.63) IL1RNERAP2GHSRERAP1OPRM1
SCHEMBL31430944 0.91 ERAP2 (0.69) IL1RNERAP2ERAP1OPRM1OPRD1
SCHEMBL31583852 0.91 ERAP2 (0.63) IL1RNERAP2GHSRERAP1
SCHEMBL29378588 0.91 ERAP2 (0.63) IL1RNERAP2GHSRERAP1
SCHEMBL31731732 0.90 GHSR (0.62) IL1RNERAP2GHSRERAP1OPRM1

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-114716507-A Preparation method and application of active peptide and active peptide composition for regulating facial flora 深圳海创生物科技有限公司 2022-07-08 — — CN claimed
CN-114716507-A Preparation method and application of active peptide and active peptide composition for regulating facial flora 深圳海创生物科技有限公司 2022-07-08 — — CN disclosed
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