SCHEMBL23260256

SCHEMBL23260256

CC[C@@H](C)C(NC(=O)[C@H](C)N)C(=O)N1CCCC1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.55
▸ KMT2A Q03164 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ ACE P12821 7/20 0.50
▸ REN P00797 4/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ F2 P00734 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ LTA4H P09960 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ PEPD P12955 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ HTR2A P28223 1/20 0.50
▸ PTGS2 P35354 1/20 0.50
▸ HRH1 P35367 1/20 0.50
▸ THPO P40225 1/20 0.50
▸ PMP22 Q01453 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ ACE2 Q9BYF1 1/20 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
SCHEMBL31202557 1.00 XIAP (0.55) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL29615598 1.00 XIAP (0.55) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL31202564 1.00 XIAP (0.55) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL30744250 0.94 XIAP (0.51) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL30051744 0.92 XIAP (0.54) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL30052312 0.91 XIAP (0.56) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL30051521 0.89 KMT2A (0.49) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL30052033 0.87 ACE (0.51) XIAPKMT2AACERENKDM4E
SCHEMBL32672659 0.86 XIAP (0.50) XIAPKMT2AL3MBTL1ACEREN
SCHEMBL30051254 0.86 XIAP (0.53) XIAPKMT2AL3MBTL1ACEREN

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-2021075792-A1 PEPTIDE COMPOSITION FOR IMPROVING SCALP HEALTH AND ALLEVIATING HAIR LOSS 주식회사 인코스팜 2021-04-22 — — WO disclosed
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