SCHEMBL9836686

SCHEMBL9836686

NCCc1ccccc1OCC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.61
POLB P06746 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HRH1 P35367 1/20 0.54
GLA P06280 1/20 0.54
TAAR1 Q96RJ0 1/20 0.53
PTGDR2 Q9Y5Y4 7/20 0.51
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
TBXAS1 P24557 2/20 0.50
ALOX15 P16050 1/20 0.48
HTT P42858 1/20 0.47
CASP1 P29466 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL4837994 0.86 L3MBTL1 (0.65) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL4752622 0.84 L3MBTL1 (0.63) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL7340039 0.84 L3MBTL1 (0.63) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL4576444 0.83 L3MBTL1 (0.66) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL5007118 0.83 HTR1A (0.64) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL7087899 0.82 LTB4R (0.54) SMN1; SMN2HRH1TAAR1HPGD
SCHEMBL6628742 0.82 PPARD (0.58) L3MBTL1SMN1; SMN2HRH1TAAR1KDM4E
SCHEMBL3169805 0.81 L3MBTL1 (0.59) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL6682898 0.81 L3MBTL1 (0.73) L3MBTL1POLBSMN1; SMN2GLAPTGDR2
SCHEMBL3409855 0.80 L3MBTL1 (0.67) L3MBTL1POLBSMN1; SMN2GLAPTGDR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0239907-B1 PHENOXYALKANECARBOXYLIC-ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS Roche Diagnostics GmbH (DE) 1991-09-18 EP disclosed
EP-0239907-A1 Phenoxyalkanecarboxylic-acid derivatives, process for their preparation and medicines containing these compounds Roche Diagnostics GmbH (DE) 1987-10-07 EP disclosed