SCHEMBL7229969

SCHEMBL7229969

O=C1c2cc(N3CCN(CCCC(c4ccccc4)c4ccccc4)CC3)ccc2CN1C1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTR Q99707 1/20 0.58
SIGMAR1 Q99720 2/20 0.43
HTR1A P08908 5/20 0.43
DRD2 P14416 3/20 0.43
DRD5 P21918 3/20 0.43
DRD3 P35462 3/20 0.43
HTR7 P34969 1/20 0.42
CCR5 P51681 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
SCHEMBL7236138 0.96 MTR (0.60) MTRSIGMAR1HTR1ADRD2DRD5
SCHEMBL7228784 0.94 MTR (0.66) MTRHTR1ADRD2DRD5DRD3
SCHEMBL7237431 0.94 MTR (0.66) MTRHTR1ADRD2DRD5DRD3
SCHEMBL7230716 0.93 MTR (0.67) MTRHTR1ADRD2DRD5DRD3
SCHEMBL7238105 0.92 MTR (0.66) MTRHTR1ADRD2DRD5DRD3
SCHEMBL7229978 0.90 MTR (0.68) MTRHTR1ADRD2DRD5DRD3
SCHEMBL7228944 0.89 MTR (0.53) MTRSIGMAR1HTR1A
SCHEMBL7228079 0.87 SIGMAR1 (0.51) MTRSIGMAR1HTR1ADRD2DRD5
SCHEMBL7228885 0.87 MTR (0.48) MTRSIGMAR1HTR1ADRD2DRD5
SCHEMBL7230812 0.86 MTR (0.66) MTRHTR1ADRD2DRD5DRD3

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 MTR 1008/4885SIGMAR1 328/4885HTR1A 2168/4885

“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.