SCHEMBL7228535

SCHEMBL7228535

CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(=O)N(CC2CC2)CC3)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.46
GPR119 Q8TDV5 12/20 0.46
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
TGFBR1 P36897 1/20 0.42
NAMPT P43490 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CNR1 P21554 1/20 0.41

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
SCHEMBL7236437 0.95 GPR119 (0.45) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL7238220 0.91 ACACB (0.47) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL7238088 0.87 ACACB (0.45) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL8627023 0.86 ITGB3 (0.50) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL5864488 0.86 PDK2 (0.41) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL5863853 0.83 PDK2 (0.50) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL7237081 0.83 SMN1; SMN2 (0.54) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL7230875 0.82 PDK2 (0.52) PDK2GPR119DDB1CRBNALDH1A1
SCHEMBL31402474 0.81 KDM4E (0.50) GPR119NAMPT
SCHEMBL7235709 0.80 PDK2 (0.46) PDK2GPR119DDB1CRBNALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6583144-B2 Piperazine substituted isoquinoline, 1,3-benzoxazine, or 1,3-benzothiazine derivatives; inhibitors against the biosynthesis of triglycerides and secretion of apolipoprotein b and treatment of hyperlipidemia MEIJI SEIKA KAISHA, LTD. (JP) 2003-06-24 US disclosed
US-20020156276-A1 Nitrogen-containing heterocyclic compounds and therapeutic agents for hyperlipidemia comprising the same OHKURA NAOTO (JP) 2002-10-24 US disclosed
US-6417362-B1 PIPERAZINE DERIVATIVES; ARTERIOSCLEROSIS, PANCREATITIS, AND CARDIOVASCULAR DISORDER TREATMENT; SIDE EFFECT REDUCTION MEIJI SEIKA KAISHA, LTD. (JP) 2002-07-09 US disclosed
EP-0999208-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS AND HYPERLIPEMIA REMEDY CONTAINING THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2000-05-10 EP 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-20020156276-A1 Nitrogen-containing heterocyclic compounds and therapeutic agents for hyperlipidemia comprising the same APOB, PNLIP, NR1H2 PDK2 2822/4885GPR119 134/4885DDB1 1500/4885

“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.