SCHEMBL8766586

SCHEMBL8766586

CCOP(=O)(OCC)C(c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)N(CCc1ccccn1)C(C)=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.42
HMGCR P04035 1/20 0.41
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 5/20 0.40
TDP1 Q9NUW8 3/20 0.38
HIF1A Q16665 1/20 0.38
IDH1 O75874 1/20 0.37
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
CYP1A2 P05177 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL8767015 0.88 MEN1 (0.47) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL8766148 0.82 HMGCR (0.46) MEN1KMT2AGAAHMGCRALDH1A1
SCHEMBL8014329 0.79 MEN1 (0.51) MEN1KMT2AGAAHMGCRALDH1A1
SCHEMBL7128247 0.78 HMGCR (0.47) MEN1KMT2AGAAHMGCRKDM4E
SCHEMBL8766484 0.75 HMGCR (0.38) MEN1KMT2AGAAHMGCRRECQL
SCHEMBL8015604 0.75 GAA (0.48) MEN1KMT2AGAAHMGCRALDH1A1
SCHEMBL7125849 0.75 MEN1 (0.45) MEN1KMT2AGAAHMGCRKDM4E
SCHEMBL8766996 0.73 HMGCR (0.44) MEN1KMT2AGAAHMGCRKDM4E
SCHEMBL8766505 0.72 MEN1 (0.39) MEN1KMT2AGAAHMGCRRECQL
SCHEMBL8766187 0.71 HMGCR (0.46) MEN1KMT2AGAAHMGCRRECQL

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-0559079-B1 Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them SYMPHAR SA (CH) 1997-08-13 EP claimed
US-5424303-A For treating hypercholesterolemia and hyperlipidemia SYMPHAR SA (CH) 1995-06-13 US claimed
EP-0559079-A1 Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them SYMPHAR S.A. (CH) 1993-09-08 EP claimed