SCHEMBL1662407

SCHEMBL1662407

COC(=O)CCc1ccccc1C1CCN(C(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
RBP4 P02753 4/20 0.43
TDP1 Q9NUW8 1/20 0.41
CHRM4 P08173 2/20 0.39
CHRM1 P11229 1/20 0.39
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL11905845 0.85 KDM4E (0.48)
SCHEMBL11919539 0.83 POLB (0.49) MEN1KMT2ATDP1
SCHEMBL4680013 0.81 RBP4 (0.45) MEN1KMT2ARBP4NPC1RAB9A
SCHEMBL6910863 0.81 SLC6A2 (0.50) TDP1
Hydrochloric Acid SCHEMBL1660306 0.80 HTR2C (0.50) TDP1
SCHEMBL2099816 0.78 RBP4 (0.47) MEN1KMT2ARBP4NPC1RAB9A
SCHEMBL2364532 0.75 MEN1 (0.43) MEN1KMT2ARBP4CHRM4CHRM1
SCHEMBL750673 0.75 RBP4 (0.55) MEN1KMT2ARBP4
SCHEMBL11920838 0.75 GPR119 (0.52) MEN1KMT2A
SCHEMBL2637185 0.74 MEN1 (0.77) MEN1KMT2ACHRM4

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-2488028-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF Merck Sharp & Dohme Corp. (US) 2012-08-22 EP disclosed
WO-2011046771-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF SCHERING CORPORATION (US) 2011-04-21 WO disclosed