SCHEMBL12113261

SCHEMBL12113261

CC(C)(C)OC(=O)N1CCC(CCC(=O)c2ccccc2N)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
PKM P14618 1/20 0.53
GPR119 Q8TDV5 8/20 0.49
FAAH O00519 1/20 0.48
STS P08842 1/20 0.45
ACHE P22303 1/20 0.45
LIMK2 P53671 1/20 0.44
TGFBR1 P36897 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43

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
SCHEMBL7732370 0.83 KDM4E (0.67) KDM4EPKMGPR119FAAHSTS
SCHEMBL1314889 0.83 ACHE (0.47) ACHE
SCHEMBL17796229 0.82 KDM4E (0.72) KDM4EPKMGPR119TGFBR1
SCHEMBL12113270 0.81 KDM4E (0.53) KDM4EPKMGPR119FAAHSTS
SCHEMBL9003283 0.81 STS (0.54) KDM4EPKMGPR119STSKMT2A
SCHEMBL17709640 0.79 HTR4 (0.66) ACHEMEN1KMT2A
SCHEMBL17721106 0.78 HTR4 (0.58) ACHEMEN1KMT2A
SCHEMBL6327293 0.78 FAAH (0.46) KDM4EPKMGPR119FAAHACHE
SCHEMBL8495313 0.78 HPGD (0.53) KDM4EPKMGPR119FAAH
SCHEMBL5742491 0.78 KDM4E (0.52) KDM4EPKMGPR119STSTGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809538-B2 Piperidine-containing compounds and use thereof ARRAY BIOPHARMA INC. (US) 2014-08-19 US disclosed
US-8809538-B2 Piperidine-containing compounds and use thereof ARRAY BIOPHARMA INC. (US) 2014-08-19 US disclosed
US-20110275608-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-11-10 US disclosed
US-20110275608-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-11-10 US disclosed
WO-2010080864-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF ARRAY BIOPHARMA INC. (US) 2010-07-15 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-20110275608-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF NOS1, NOS2, ASS1 KDM4E 1611/4885PKM 2057/4885GPR119 5/4885

“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.