SCHEMBL7230341

SCHEMBL7230341

O=C1c2cc(N3CCN(Cc4ccc(O)cc4)CC3)ccc2CN1C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.44
KIF11 P52732 5/20 0.43
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
CCR5 P51681 1/20 0.40
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
PARP1 P09874 2/20 0.38
PARP2 Q9UGN5 2/20 0.38
TMEM97 Q5BJF2 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
HTR1A P08908 1/20 0.38
ADRA2C P18825 1/20 0.38
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
L3MBTL3 Q96JM7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CRBN Q96SW2 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
SCHEMBL7237830 0.91 MAPT (0.44) DRD4ALDH1A1MAPTCCR5DRD2
SCHEMBL7230255 0.90 MAPT (0.46) DRD4ALDH1A1GAAMAPTCCR5
SCHEMBL7230236 0.90 PARP1 (0.46) ALDH1A1MAPTCCR5PARP1PARP2
SCHEMBL7229644 0.90 DRD4 (0.45) DRD4KIF11CCR5DRD2DRD3
SCHEMBL7228804 0.88 SMN1; SMN2 (0.45) DRD4ALDH1A1CCR5DRD2DRD3
SCHEMBL7238118 0.88 CCR5 (0.48) DRD4KIF11ALDH1A1CCR5HRH1
SCHEMBL7238624 0.87 CRBN (0.46) DRD4ALDH1A1MAPTDRD2DRD3
SCHEMBL7228704 0.86 POLB (0.48) MAPT
SCHEMBL7238561 0.85 MAPT (0.47) ALDH1A1MAPTSIGMAR1HTR1A
SCHEMBL7229226 0.82 PARP1 (0.50) DRD4ALDH1A1DRD2DRD3PARP1

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 DRD4 2812/4885KIF11 4795/4885ALDH1A1 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.