SCHEMBL10362346

SCHEMBL10362346

C=CC(=O)NCCCCOc1ccccc1C=O

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.54
▸ HTT P42858 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ PTGDR2 Q9Y5Y4 1/20 0.50
▸ TGM2 P21980 1/20 0.50
▸ KMT2A Q03164 2/20 0.46
▸ MTNR1A P48039 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ RAD52 P43351 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ ZDHHC20 Q5W0Z9 1/20 0.43
▸ ZDHHC2 Q9UIJ5 1/20 0.43
▸ ITK Q08881 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HCRTR1 O43613 1/20 0.40

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
SCHEMBL10803446 0.90 TGM2 (0.56) ALDH1A1TGM2KMT2AMTNR1AMEN1
SCHEMBL10362590 0.90 MTNR1A (0.46) ALDH1A1HTTHPGDSMN1; SMN2PTGDR2
SCHEMBL10818993 0.86 GAA (0.54) ALDH1A1HTTSMN1; SMN2TGM2KMT2A
SCHEMBL10363161 0.84 TGM2 (0.51) ALDH1A1SMN1; SMN2TGM2KMT2AGAA
SCHEMBL10810049 0.84 HDAC8 (0.45) ALDH1A1TGM2KMT2AMTNR1AMEN1
SCHEMBL10364043 0.83 TGM2 (0.50) ALDH1A1HPGDSMN1; SMN2TGM2KMT2A
SCHEMBL10362427 0.83 ALDH1A1 (0.57) ALDH1A1HTTHPGDSMN1; SMN2TGM2
SCHEMBL10363944 0.83 LMNA (0.59) ALDH1A1HPGDSMN1; SMN2TGM2KMT2A
SCHEMBL10806562 0.83 TGM2 (0.53) ALDH1A1HTTTGM2KMT2AMEN1
SCHEMBL10804625 0.83 HCRTR1 (0.44) ALDH1A1HPGDSMN1; SMN2TGM2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0155177-B1 UNSATURATED CYCLIC AMIDO-SUBSTITUTED ETHER COMPOUNDS AND PREPARATION PROCESS THEREOF MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-10-31 — — EP disclosed
US-4649219-A CROSSLINKERS, ADHESIVES, PAINTS MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1987-03-10 — — US disclosed
EP-0155177-A2 Unsaturated cyclic amido-substituted ether compounds and preparation process thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-09-18 — — EP disclosed
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