SCHEMBL29980128

SCHEMBL29980128

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

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NMUR2 Q9GZQ4 5/20 0.58
▸ NMUR1 Q9HB89 5/20 0.58
▸ EPHA2 P29317 2/20 0.53
▸ OPRM1 P35372 1/20 0.53
▸ OPRD1 P41143 1/20 0.53
▸ KDM1A O60341 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ KDM5A P29375 1/20 0.51
▸ KDM1B Q8NB78 1/20 0.51
▸ TFPI P10646 2/20 0.50

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
SCHEMBL29980542 0.92 EPHA2 (0.59) NMUR2NMUR1EPHA2OPRM1OPRD1
SCHEMBL29980543 0.91 EPHA2 (0.57) NMUR2NMUR1EPHA2OPRM1OPRD1
SCHEMBL29980254 0.89 KDM1A (0.63) NMUR2NMUR1EPHA2KDM1AMAOB
SCHEMBL30844077 0.86 OPRD1 (0.66) NMUR2NMUR1EPHA2OPRM1OPRD1
SCHEMBL9807256 0.85 EPHA2 (0.59) EPHA2KDM1AMAOBKDM5AKDM1B
SCHEMBL31665899 0.85 EPHA2 (0.57) NMUR2NMUR1EPHA2OPRM1OPRD1
SCHEMBL30038002 0.83 NPY4R (0.59) OPRM1OPRD1
SCHEMBL31084238 0.83 F2 (0.62) NMUR2NMUR1
SCHEMBL9807245 0.82 EPHA2 (0.61) EPHA2
SCHEMBL30512535 0.82 NMUR2 (0.63) NMUR2NMUR1OPRM1OPRD1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113817023-B FGFR 4-targeted affinity peptide and application thereof 中国药科大学 2022-10-04 — — CN claimed
CN-115477690-B Affinity peptide of target FGFR4 and application thereof 中国药科大学 2025-01-03 — — CN disclosed
CN-115477690-A FGFR 4-targeted affinity peptide and application thereof 中国药科大学 2022-12-16 — — CN disclosed
CN-113817023-B FGFR 4-targeted affinity peptide and application thereof 中国药科大学 2022-10-04 — — CN disclosed
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