SCHEMBL6164942

SCHEMBL6164942

CC(C)(C)OC(=O)NC(C)(C)C(=O)NC(CSCc1ccccc1)C(=O)N1CCC(c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.48
PPARA Q07869 4/20 0.48
KMT2A Q03164 2/20 0.46
MAPK1 P28482 1/20 0.46
CCKBR P32239 1/20 0.45
PPARD Q03181 2/20 0.45
CCR1 P32246 6/20 0.44
F13A1 P00488 1/20 0.42
TGM2 P21980 1/20 0.42
TGM1 P22735 1/20 0.42
PABPC1 P11940 1/20 0.42
GAA P10253 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL6164945 1.00 PPARG (0.48) PPARGPPARAKMT2AMAPK1CCKBR
SCHEMBL6161108 0.91 PPARG (0.59) PPARGPPARAKMT2AMAPK1CCKBR
SCHEMBL6161114 0.91 PPARG (0.59) PPARGPPARAKMT2AMAPK1CCKBR
SCHEMBL6179686 0.86 F13A1 (0.49) KMT2AMAPK1CCKBRCCR1F13A1
SCHEMBL6162932 0.86 PPARA (0.48) PPARGPPARAKMT2AMAPK1CCKBR
SCHEMBL6162935 0.86 PPARA (0.48) PPARGPPARAKMT2AMAPK1CCKBR
SCHEMBL6162563 0.84 CCKBR (0.49) CCKBRCCR1
SCHEMBL6162558 0.84 CCKBR (0.49) CCKBRCCR1
Hydrochloric Acid SCHEMBL6161340 0.83 CCKBR (0.49) CCKBRCCR1
Hydrochloric Acid SCHEMBL6161333 0.83 CCKBR (0.49) CCKBRCCR1

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