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Sugi Predict / Compounds / SCHEMBL6162501

SCHEMBL6162501

SCHEMBL6162501

CC(=O)Nc1ccc2c(c1)CN(C(=O)C(COCc1ccccc1)NC(=O)C(C)(C)NC(=O)OC(C)(C)C)CC2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 2/20 0.42
▸ HCRTR2 O43614 8/20 0.41
▸ GHSR Q92847 2/20 0.41
▸ CTSS P25774 1/20 0.41
▸ CCKBR P32239 2/20 0.40
▸ HCRTR1 O43613 4/20 0.40
▸ PPARG P37231 1/20 0.39
▸ UGCG Q16739 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39

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
SCHEMBL6162496 1.00 PPARA (0.42) PPARAHCRTR2GHSRCTSSCCKBR
SCHEMBL8413200 0.93 PPARA (0.43) PPARAHCRTR2GHSRCTSSCCKBR
SCHEMBL6162692 0.89 NR1H2 (0.48) PPARAHCRTR2GHSRCTSSHCRTR1
SCHEMBL6162688 0.89 NR1H2 (0.48) PPARAHCRTR2GHSRCTSSHCRTR1
SCHEMBL6160785 0.88 GHSR (0.52) HCRTR2GHSRCCKBRUGCGCYP3A4
SCHEMBL6160779 0.88 GHSR (0.52) HCRTR2GHSRCCKBRUGCGCYP3A4
SCHEMBL6162216 0.87 KCNA1 (0.48) PPARAHCRTR2GHSRCTSSCCKBR
SCHEMBL6166160 0.86 CCKBR (0.44) PPARAHCRTR2GHSRCTSSCCKBR
SCHEMBL6166156 0.86 CCKBR (0.44) PPARAHCRTR2GHSRCTSSCCKBR
SCHEMBL6163229 0.86 DRD2 (0.44) PPARAHCRTR2GHSRCTSSHCRTR1

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
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 — — EP disclosed