SCHEMBL7229795

SCHEMBL7229795

CCC(C(=O)O)N1Cc2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)cc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.47
PDK2 Q15119 1/20 0.46
NAMPT P43490 1/20 0.44
ACACB O00763 1/20 0.42
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP2C19 P33261 1/20 0.41
ESRRB O95718 1/20 0.41
ESR1 P03372 1/20 0.41
ESRRA P11474 1/20 0.41
ESRRG P62508 1/20 0.41
GPR119 Q8TDV5 4/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ESR2 Q92731 1/20 0.39

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
SCHEMBL8897232 0.91 MAPT (0.46) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL27376738 0.82 PDK2 (0.41) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL7235836 0.81 PDK2 (0.53) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL7238134 0.78 PDK2 (0.51) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL31554733 0.78 PDK2 (0.42) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL7238220 0.77 ACACB (0.47) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL20211883 0.76 PDK2 (0.42) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL20231940 0.76 PDK2 (0.42) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL30612712 0.76 PDK2 (0.42) MAPTLMNAALDH1A1PDK2NAMPT
SCHEMBL30517962 0.76 PDK2 (0.42) MAPTLMNAALDH1A1PDK2NAMPT

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 MAPT 4810/4885LMNA 1399/4885ALDH1A1 3399/4885

“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.