SCHEMBL27302986

SCHEMBL27302986

CC(C)OC(=O)C(C)(C)Oc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.61
PPARA Q07869 6/20 0.61
TSHR P16473 4/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
CYP1A2 P05177 3/20 0.61
CYP3A4 P08684 3/20 0.61
MAPT P10636 3/20 0.61
CYP2C19 P33261 3/20 0.61
ABCB11 O95342 2/20 0.61
HTR2A P28223 2/20 0.61
PMP22 Q01453 2/20 0.61
CNR1 P21554 2/20 0.61
CYP2C9 P11712 2/20 0.61
ATM Q13315 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
USP2 O75604 1/20 0.61
LMNA P02545 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
ADRB3 P13945 1/20 0.61

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
SCHEMBL22221536 0.88 PPARG (0.77) PPARGPPARATSHRMEN1KMT2A
SCHEMBL16527438 0.85 PPARA (0.54) PPARGPPARATSHRMEN1KMT2A
SCHEMBL23605937 0.84 PPARA (0.64) PPARGPPARATSHRMEN1KMT2A
SCHEMBL21991759 0.84 PPARA (0.64) PPARGPPARATSHRMEN1KMT2A
SCHEMBL22209011 0.84 MAPT (0.60) PPARGPPARATSHRMEN1KMT2A
Ethane SCHEMBL16527723 0.84 PPARA (0.53) PPARGPPARATSHRMEN1KMT2A
SCHEMBL21992457 0.83 CNR1 (0.86) PPARGPPARATSHRMEN1KMT2A
SCHEMBL440419 0.83 PPARA (0.58) PPARGPPARATSHRMEN1KMT2A
SCHEMBL28653724 0.83 PPARA (0.62) PPARGPPARATSHRMEN1KMT2A
SCHEMBL21991235 0.83 PPARA (0.62) PPARGPPARATSHRMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1035178-C Arylamide derivatives SS PHARMACEUTICAL CO (JP) 1997-06-18 CN disclosed
CN-1094039-A Arylamide derivatives SS PHARMACEUTICAL CO (JP) 1994-10-26 CN disclosed