SCHEMBL7083355

SCHEMBL7083355

C[Si](C)(C)CCOCOc1cc2ccccc2cc1OC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
POLB P06746 1/20 0.35
CASP6 P55212 1/20 0.35
DGAT1 O75907 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
PDE10A Q9Y233 1/20 0.34
KMT2A Q03164 2/20 0.33
RECQL P46063 1/20 0.33
HTT P42858 1/20 0.33
PTPN7 P35236 1/20 0.33
NCEH1 Q6PIU2 1/20 0.33
BRD4 O60885 1/20 0.33

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
SCHEMBL7083354 0.84 KDM4E (0.52) ALDH1A1HPGDKDM4ESMN1; SMN2POLB
SCHEMBL6042146 0.80 PLA2G2A (0.45) ALDH1A1HPGDKDM4ESMN1; SMN2L3MBTL1
SCHEMBL6042018 0.78 PDE4A (0.36) ALDH1A1HPGDKDM4ESMN1; SMN2PDE10A
SCHEMBL6042263 0.76 PDE10A (0.35) ALDH1A1HPGDKDM4ESMN1; SMN2TSHR
SCHEMBL8577459 0.75 ALDH1A1 (0.58) ALDH1A1HPGDKDM4ESMN1; SMN2TSHR
SCHEMBL4419587 0.75 ALDH1A1 (0.39) ALDH1A1HPGDKDM4ESMN1; SMN2MTNR1A
SCHEMBL8216043 0.75 KCNA3 (0.46) ALDH1A1MTNR1AMTNR1BL3MBTL1RECQL
SCHEMBL31286516 0.74 ALDH1A1 (0.41) ALDH1A1HPGDKDM4ESMN1; SMN2POLB
SCHEMBL7058048 0.74 KDM4E (0.52) ALDH1A1HPGDKDM4EPOLBCASP6
SCHEMBL9127984 0.74 ALDH1A1 (0.42) ALDH1A1KDM4ESMN1; SMN2TSHRL3MBTL1

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-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP disclosed
EP-0863875-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1998-09-16 EP disclosed
WO-1997009311-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1997-03-13 WO disclosed