SCHEMBL24579230

SCHEMBL24579230

O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC(c1ccccc1)(c1ccc(C2CCCCCCCC2)cc1)c1ccccc1Cl)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.39
▸ ACE P12821 9/20 0.37
▸ ACE2 Q9BYF1 5/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ XIAP P98170 2/20 0.36

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
SCHEMBL24579344 0.92 KMT2A (0.39) ACEACE2XIAP
SCHEMBL24828861 0.88 PRCP (0.39) PRCPACEACE2
SCHEMBL22388727 0.88 PRCP (0.39) PRCPACEACE2
SCHEMBL22388726 0.88 PRCP (0.39) PRCPACEACE2
SCHEMBL29696683 0.87 PRCP (0.46) PRCPACEACE2
SCHEMBL24580348 0.87 PRCP (0.42) PRCP
SCHEMBL24579905 0.86 FABP7 (0.37) —
SCHEMBL23157168 0.83 PTPN1 (0.36) —
SCHEMBL24965903 0.82 MDM4 (0.38) —
SCHEMBL24965995 0.82 MDM4 (0.38) —

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-2022138891-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE 中外製薬株式会社 2022-06-30 — — WO disclosed
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