SCHEMBL531534

SCHEMBL531534

C[C@@H]([C@H](O[Si](C)(C)C(C)(C)C)c1nnn[nH]1)N(Cc1ccccc1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ATM Q13315 2/20 0.35
POLB P06746 3/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
APLNR P35414 1/20 0.33
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP2C9 P11712 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
RIPK1 Q13546 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL532201 0.82 CYP1A2 (0.38) MEN1KMT2AATMAPLNR
SCHEMBL532611 0.79 NPSR1 (0.37) MEN1KMT2AATMALDH1A1LMNA
SCHEMBL532131 0.77 MEN1 (0.36) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL22370925 0.76 MEN1 (0.48) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL3336723 0.75 MEN1 (0.39) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL14910876 0.75 MEN1 (0.43) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL531473 0.74 MEN1 (0.41) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL531745 0.74 MEN1 (0.41) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL2391342 0.74 KMT2A (0.41) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL532600 0.73 MEN1 (0.40) MEN1KMT2AATMPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415759-A1 CETP inhibitors Merck Sharp & Dohme Corporation (US) 2012-02-08 EP disclosed