SCHEMBL31114616

SCHEMBL31114616

CCCCC[Si](C)(C)N(C)C(C)=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
CES2 O00748 4/20 0.34
CES1 P23141 4/20 0.34
EPHX1 P07099 5/20 0.34
DNM1 Q05193 2/20 0.34
AKR1B1 P15121 1/20 0.33
FAAH O00519 1/20 0.32
PPARG P37231 3/20 0.32
PPARD Q03181 3/20 0.32
PPARA Q07869 3/20 0.32
TSHR P16473 2/20 0.32
GPR84 Q9NQS5 2/20 0.32
HDAC11 Q96DB2 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32
TLR2 O60603 1/20 0.32
MEN1 O00255 1/20 0.32
ESR1 P03372 1/20 0.32
FABP4 P15090 1/20 0.32

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
SCHEMBL31114581 0.98 EPHX1 (0.38) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL31114376 0.98 EPHX1 (0.38) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL9634449 0.98 EPHX1 (0.38) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL31114568 0.98 EPHX1 (0.38) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL31114642 0.98 EPHX1 (0.38) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL31114572 0.98 EPHX1 (0.38) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL31114549 0.94 ALDH1A1 (0.37) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL31114562 0.85 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8854335 0.79 EPHX1 (0.39) ALDH1A1CES2CES1EPHX1DNM1
SCHEMBL29364881 0.77 FAAH (0.41) CES2CES1EPHX1FAAHMEN1

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
CN-111886676-B Method for treating surface of wafer and composition therefor 中央硝子株式会社 2024-09-27 CN claimed