SCHEMBL29213124

SCHEMBL29213124

CCCCCCCCCCCCCC(F)(CCCCCCC)[Si](Cl)(Cl)Cl

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.42
LPAR1 Q92633 1/20 0.42
LPAR3 Q9UBY5 1/20 0.42
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.38
SMPD1 P17405 2/20 0.38
FDPS P14324 2/20 0.38
ALDH1A1 P00352 1/20 0.36
FAAH O00519 7/20 0.35
CES1 P23141 5/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GGPS1 O95749 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
SCHEMBL19858478 1.00 CES2 (0.42) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL28352166 1.00 CES2 (0.42) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL29012028 0.77 CES2 (0.39) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL3440984 0.77 CES2 (0.39) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL6239174 0.77 CES2 (0.39) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL25335915 0.76 CES2 (0.38) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL28517614 0.76 CES2 (0.38) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL25414443 0.76 CES2 (0.38) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL17442479 0.73 TSHR (0.40) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL3685731 0.72 CES2 (0.46) CES2LPAR1LPAR3TSHRTHRB

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-117902662-A Preparation method of interface photo-thermal evaporator with both hydrophobic salt resistance and hydrophilic oil resistance 浙江大学 2024-04-19 CN disclosed