SCHEMBL25627167

SCHEMBL25627167

NCC(=O)NC(CC(N)=O)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccccc1)C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.56
▸ PTPN2 P17706 1/20 0.56
▸ ACE P12821 1/20 0.52
▸ CHRNA1 P02708 1/20 0.51
▸ CHRNG P07510 1/20 0.51
▸ CHRNB1 P11230 1/20 0.51
▸ CHRND Q07001 1/20 0.51

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
SCHEMBL30316218 0.94 PTPN1 (0.58) PTPN1PTPN2ACECHRNA1CHRNG
SCHEMBL25627092 0.93 PTPN1 (0.55) PTPN1PTPN2ACECHRNA1CHRNG
SCHEMBL25626695 0.88 PTPN1 (0.51) PTPN1PTPN2ACE
SCHEMBL25627812 0.88 PTPN1 (0.51) PTPN1PTPN2ACE
SCHEMBL31198202 0.88 MEN1 (0.52) PTPN1PTPN2ACECHRNA1CHRNG
SCHEMBL31514370 0.87 MME (0.53) PTPN1ACE
SCHEMBL25627280 0.87 REN (0.61) PTPN1ACE
SCHEMBL25627202 0.86 OPRD1 (0.57) PTPN1PTPN2ACE
SCHEMBL25626694 0.86 ACE (0.49) PTPN1PTPN2ACECHRNA1CHRNG
SCHEMBL25627489 0.86 PTPN1 (0.48) PTPN1PTPN2ACE

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-2023106897-A1 NOVEL PEPTIDE DERIVATIVE DERIVED FROM ADIPONECTIN AND USE THEREOF 서울대학교병원 2023-06-15 — — WO disclosed
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