SCHEMBL27468638

SCHEMBL27468638

[O]Cc1ccccc1C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.46
NAAA Q02083 1/20 0.45
PTGS2 P35354 1/20 0.41
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
CEL P19835 2/20 0.37
PTPRC P08575 1/20 0.36
PTPRF P10586 1/20 0.36
PTPN1 P18031 1/20 0.36
CDC25B P30305 1/20 0.36
HTR1D P28221 2/20 0.36
HTR1B P28222 2/20 0.36
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
CYP19A1 P11511 2/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL522584 0.98 PTGDR2 (0.44) PTGDR2NAAAPTGS2SLC6A2SLC6A4
SCHEMBL17986291 0.90 SLC6A2 (0.42) PTGDR2NAAASLC6A2SLC6A4SLC6A3
SCHEMBL5821254 0.84 PTGDR2 (0.46) PTGDR2NAAAPTGS2SLC6A2SLC6A4
SCHEMBL12474580 0.82 PTGDR2 (0.44) PTGDR2NAAAPTGS2SLC6A2SLC6A4
Formaldehyde SCHEMBL27876727 0.81 PTGDR2 (0.44) PTGDR2NAAAPTGS2SLC6A2SLC6A4
SCHEMBL11754963 0.80 PTGDR2 (0.42) PTGDR2NAAAPTGS2SLC6A2SLC6A4
SCHEMBL5283227 0.80 PTGDR2 (0.42) PTGDR2NAAAPTGS2SLC6A2SLC6A4
SCHEMBL11265348 0.80 PTGDR2 (0.42) PTGDR2NAAAPTGS2SLC6A2SLC6A4
SCHEMBL477417 0.80 PTGDR2 (0.46) PTGDR2NAAAPTGS2SLC6A2SLC6A4
SCHEMBL677543 0.80 PTGDR2 (0.42) PTGDR2NAAAPTGS2SLC6A2SLC6A4

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-1152024-C Substituted 3-phenyl-5-alkoxy-1, 3, 4-oxadiazol-2-ones and their use as lipase inhibitors ���ĵ�˹ҩ��¹����޹�˾ 2004-06-02 CN disclosed