SCHEMBL9690647

SCHEMBL9690647

CC(C)COC(=O)c1ccccc1OCC(O)CSc1nc(-c2ccccc2)c(-c2ccccc2)o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
POLB P06746 4/20 0.47
ALDH1A1 P00352 6/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
KDM4E B2RXH2 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
GAA P10253 2/20 0.45
HPGD P15428 2/20 0.43
TSHR P16473 3/20 0.41
HSD17B10 Q99714 3/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALOX15 P16050 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPK1 P28482 1/20 0.39
MAPT P10636 2/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39

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
SCHEMBL9123644 0.89 LMNA (0.49) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL9690639 0.85 LMNA (0.48) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL9124271 0.82 RAB9A (0.47) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL9692380 0.80 ALDH1A1 (0.41) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL9123641 0.79 LMNA (0.48) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL9693022 0.76 TSHR (0.56) LMNAALDH1A1MEN1KMT2AHPGD
SCHEMBL9690575 0.76 TSHR (0.49) ALDH1A1MEN1KMT2AHPGDTSHR
SCHEMBL9692121 0.74 RAB9A (0.57) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL9125661 0.73 APEX1 (0.51) POLBALDH1A1MEN1KMT2AHPGD
SCHEMBL10447756 0.73 HSD17B10 (0.62) LMNAPOLBALDH1A1MEN1KMT2A

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-0520552-A1 Derivatives of (hetero) aromatic ethers and thioethers having antihyperlipidemic activity, process for their preparation and pharmaceutical compositions containing them PIERREL S.p.A. (IT) 1992-12-30 EP claimed
EP-0520552-A1 Derivatives of (hetero) aromatic ethers and thioethers having antihyperlipidemic activity, process for their preparation and pharmaceutical compositions containing them PIERREL S.p.A. (IT) 1992-12-30 EP disclosed