SCHEMBL3778413

SCHEMBL3778413

C=C(CCC(=O)O[Si](CCCCCCCCCCCC)(CCCCCCCCCCCC)CCCCCCCCCCCC)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PGGT1B P53609 1/20 0.38
PAM P19021 2/20 0.37
GPR84 Q9NQS5 7/20 0.36
PPARG P37231 7/20 0.36
PPARD Q03181 7/20 0.36
PPARA Q07869 7/20 0.36
HDAC11 Q96DB2 5/20 0.36
TSHR P16473 4/20 0.36
PTPN1 P18031 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TLR2 O60603 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
FABP4 P15090 2/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
SLC22A8 Q8TCC7 1/20 0.36
MEN1 O00255 1/20 0.36
ESR1 P03372 1/20 0.36

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
SCHEMBL3787347 1.00 THRB (0.38) THRBFNTAFNTBPGGT1BPAM
SCHEMBL3782450 0.98 THRB (0.35) THRBFNTAFNTBPGGT1BPAM
SCHEMBL3780717 0.94 CA12 (0.33) THRBFNTAFNTBPGGT1BPAM
SCHEMBL3790480 0.87 ALDH1A1 (0.30) ALDH1A1
SCHEMBL6545164 0.85 DGKA (0.44) PAMGPR84PPARGPPARDPPARA
SCHEMBL4646045 0.80 DGKA (0.40) PAMGPR84PPARGPPARDPPARA
SCHEMBL4644015 0.80 DGKA (0.40) PAMGPR84PPARGPPARDPPARA
SCHEMBL3782646 0.80 TBXAS1 (0.32) TSHR
SCHEMBL6545816 0.80 DGKA (0.47) PAMGPR84PPARGPPARDPPARA
SCHEMBL4641772 0.79 DGKA (0.43) PAMTSHRALDH1A1MEN1KMT2A

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
US-20100183540-A1 BRANCHED POLYMER AND ANTIFOULING COATING COMPOSITION COMPRISING THE POLYMER JOTUN A/S (NO) 2010-07-22 US disclosed