SCHEMBL7228569

SCHEMBL7228569

CC1(C)c2ccc(N3CCN(CCC(c4ccccc4)c4ccccc4)CC3)cc2C(=O)N1Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.43
HTR7 P34969 4/20 0.43
HTR6 P50406 4/20 0.43
CCR2 P41597 3/20 0.41
ADRA1D P25100 2/20 0.39
ADRA1A P35348 2/20 0.39
ADRA1B P35368 2/20 0.39
SIGMAR1 Q99720 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
SCHEMBL7229214 0.89 KDM4E (0.40) HTR1A
SCHEMBL7229506 0.85 HTR1A (0.41) HTR1ASIGMAR1
SCHEMBL7235824 0.85 CCR2 (0.40) HTR1AHTR7HTR6CCR2ADRA1D
SCHEMBL7228128 0.80 HTR1A (0.42) HTR1ASIGMAR1
SCHEMBL7229590 0.79 DRD3 (0.48) HTR1AHTR7CCR2ADRA1DADRA1A
SCHEMBL7228845 0.78 DRD2 (0.47) HTR1ACCR2ADRA1DADRA1AADRA1B
SCHEMBL7230200 0.77 SIGMAR1 (0.42) HTR1AHTR7CCR2ADRA1DADRA1A
SCHEMBL7236722 0.76 MTR (0.49) HTR1AHTR7
SCHEMBL7229121 0.75 SIGMAR1 (0.42) HTR1ACCR2ADRA1DADRA1AADRA1B
SCHEMBL7228557 0.75 DRD2 (0.52)

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 HTR1A 2168/4885HTR7 2786/4885HTR6 2034/4885

“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.