SCHEMBL9979700

SCHEMBL9979700

CCOC(=O)Cc1coc2cc(COc3cccc4c3CN(c3ccc(C(F)(F)F)cc3)C4=O)ccc12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 5/20 0.46
PPARA Q07869 4/20 0.46
PPARG P37231 1/20 0.46
POLB P06746 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.39
UGCG Q16739 7/20 0.39
MAPT P10636 3/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CHRNB2 P17787 1/20 0.36
HTR1B P28222 1/20 0.36
SLC6A4 P31645 1/20 0.36
CHRNA4 P43681 1/20 0.36
SLC26A3 P40879 1/20 0.36
PTGER4 P35408 1/20 0.35

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
SCHEMBL9979622 0.90 PPARD (0.57) PPARDPPARAPPARGUGCGSLC26A3
SCHEMBL9979510 0.86 PPARD (0.53) PPARDPPARAPPARGPOLBMEN1
SCHEMBL9979624 0.84 PPARD (0.38) PPARDPPARAPPARGPOLBMEN1
SCHEMBL9979618 0.79 PPARD (0.44) PPARDPPARAPPARGPOLBMEN1
SCHEMBL9979584 0.77 POLB (0.44) PPARDPOLBMEN1KMT2AGAA
SCHEMBL9979520 0.76 PPARD (0.43) PPARDPPARAPPARGPOLBMEN1
SCHEMBL9979623 0.76 PPARD (0.67) PPARDPPARAPPARGPTGER4
SCHEMBL9979703 0.75 L3MBTL1 (0.36) PPARDPPARAPPARGPOLBMEN1
SCHEMBL9979668 0.75 POLB (0.43) POLBMEN1KMT2AGAAMAPT
SCHEMBL9979617 0.73 PPARD (0.46) PPARDPPARAPPARGUGCGMAPT

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-2012081570-A1 LACTAM COMPOUND OR A SALT THEREOF, AND PPAR ACTIVATOR あすか製薬株式会社 (JP) 2012-06-21 WO disclosed