SCHEMBL9506499

SCHEMBL9506499

CCCCCCC(=O)c1ccc(C=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 7/20 0.67
HTR7 P34969 1/20 0.54
STS P08842 4/20 0.54
THRA P10827 3/20 0.50
THRB P10828 3/20 0.50
S1PR2 O95136 1/20 0.50
S1PR1 P21453 1/20 0.50
S1PR3 Q99500 1/20 0.50
LPAR2 Q9HBW0 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
S1PR5 Q9H228 1/20 0.48

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
SCHEMBL3844202 1.00 HSD17B3 (0.67) HSD17B3HTR7STSTHRATHRB
SCHEMBL6839650 1.00 HSD17B3 (0.67) HSD17B3HTR7STSTHRATHRB
SCHEMBL3027932 0.98 HSD17B3 (0.66) HSD17B3HTR7STSTHRATHRB
SCHEMBL6579608 0.93 HSD17B3 (0.65) HSD17B3HTR7STSL3MBTL1
SCHEMBL2903307 0.92 HSD17B3 (0.58) HSD17B3LMNAMAPT
SCHEMBL13085794 0.87 HSD17B3 (0.85) HSD17B3HTR7STSTHRATHRB
SCHEMBL13085847 0.87 HSD17B3 (0.85) HSD17B3HTR7STSTHRATHRB
SCHEMBL5213534 0.86 HSD17B3 (0.51) HSD17B3STSL3MBTL1LMNAMAPT
SCHEMBL6579588 0.85 HSD17B3 (0.62) HSD17B3HTR7STSL3MBTL1
SCHEMBL18753070 0.85 HSD17B3 (0.84) HSD17B3HTR7STSTHRATHRB

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
EP-0549808-A1 TRANSPARENT PLASTIC MATERIAL SEIKO EPSON CORPORATION (JP) 1993-07-07 EP disclosed