SCHEMBL30331574

SCHEMBL30331574

CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.63
▸ NPY2R P49146 7/20 0.60
▸ NPY4R P50391 7/20 0.60
▸ NPY5R Q15761 7/20 0.60
▸ NPY1R P25929 5/20 0.60
▸ EPHA2 P29317 2/20 0.60
▸ MAOB P27338 1/20 0.59
▸ KDM5A P29375 1/20 0.59
▸ KDM1B Q8NB78 1/20 0.59
▸ TFPI P10646 5/20 0.58
▸ IL23R Q5VWK5 1/20 0.55

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
SCHEMBL31598492 0.94 KDM1A (0.59) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL30844350 0.91 KDM1A (0.62) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL30063854 0.89 EPHA2 (0.57) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL30844362 0.89 EPHA2 (0.63) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL30844258 0.89 EPHA2 (0.63) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL30844318 0.89 EPHA2 (0.63) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL30844294 0.89 EPHA2 (0.63) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL9807269 0.88 EPHA2 (0.63) KDM1ANPY1REPHA2TFPI
SCHEMBL30567748 0.88 NMUR2 (0.65) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL30607473 0.88 NPY2R (0.63) NPY2RNPY4RNPY5RNPY1REPHA2

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-112500451-B Peptide compound for repairing skin immunity and application thereof 中科南京绿色制造产业创新研究院 2023-04-14 — — CN claimed
CN-112500451-B Peptide compound for repairing skin immunity and application thereof 中科南京绿色制造产业创新研究院 2023-04-14 — — CN disclosed
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