SCHEMBL6912571

SCHEMBL6912571

CC(C)(C)OC(=O)N1CCC(C#N)(c2cc(F)ccc2Br)CC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.42
HDAC2 Q92769 2/20 0.41
HDAC1 Q13547 1/20 0.41
JAK2 O60674 11/20 0.41
JAK1 P23458 11/20 0.41
MC4R P32245 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RORC P51449 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
SCHEMBL1659401 0.89 HDAC2 (0.43) GPR119HDAC2HDAC1JAK2JAK1
SCHEMBL2468693 0.89 GPR119 (0.43) GPR119HDAC2HDAC1JAK2JAK1
SCHEMBL7527349 0.88 GPR119 (0.44) GPR119HDAC2HDAC1JAK2JAK1
SCHEMBL29995192 0.88 GPR119 (0.44) GPR119HDAC2HDAC1JAK2JAK1
SCHEMBL31415651 0.87 MEN1 (0.44) GPR119JAK2JAK1LMNA
SCHEMBL4362609 0.84 GPR119 (0.44) GPR119HDAC1JAK2JAK1
SCHEMBL29446735 0.84 GPR119 (0.44) GPR119HDAC1JAK2JAK1
SCHEMBL28597678 0.83 USP30 (0.46) GPR119HDAC2HDAC1JAK2JAK1
SCHEMBL3925930 0.82 RORC (0.48) HDAC2HDAC1JAK2JAK1RORC
SCHEMBL19078386 0.81 TACR1 (0.44) GPR119JAK2JAK1LMNARORC

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
US-20140336222-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME (US) 2014-11-13 US disclosed
US-8859776-B2 Substituted piperidines that increase p53 activity and the uses thereof MERCK SHARP & DOHME CORP. (US) 2014-10-14 US disclosed
WO-2011046771-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF SCHERING CORPORATION (US) 2011-04-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140336222-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF TP53, TP53BP1, MDM2 GPR119 4605/4885HDAC2 191/4885HDAC1 71/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.