SCHEMBL7238561

SCHEMBL7238561

O=C1c2cc(N3CCN(Cc4cccc(Cl)c4)CC3)ccc2CN1C1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
TSHR P16473 1/20 0.47
CHRM2 P08172 3/20 0.46
CHRM3 P20309 3/20 0.46
SIGMAR1 Q99720 2/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH3A1 P30838 1/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
LMNA P02545 2/20 0.42
HTR1A P08908 1/20 0.42
HTR7 P34969 1/20 0.42
NR5A2 O00482 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL7229644 0.91 DRD4 (0.45) CHRM2CHRM3SIGMAR1HTR1A
SCHEMBL7237830 0.90 MAPT (0.44) MAPTSIGMAR1ALDH1A1KDM4EHTR1A
SCHEMBL7228804 0.87 SMN1; SMN2 (0.45) SIGMAR1ALDH1A1KDM4EHTR1ASMN1; SMN2
SCHEMBL7238118 0.85 CCR5 (0.48) TSHRALDH1A1CYP2C9
SCHEMBL7230236 0.85 PARP1 (0.46) MAPTALDH1A1KDM4E
SCHEMBL7230255 0.85 MAPT (0.46) MAPTTSHRALDH1A1KDM4ETP53
SCHEMBL7230341 0.85 DRD4 (0.44) MAPTSIGMAR1ALDH1A1HTR1A
SCHEMBL7229226 0.84 PARP1 (0.50) TSHRCHRM2CHRM3ALDH1A1KDM4E
SCHEMBL7228889 0.83 ALDH1A1 (0.49) MAPTTSHRCHRM3SIGMAR1ALDH1A1
SCHEMBL7238624 0.83 CRBN (0.46) MAPTALDH1A1KDM4ECYP2C9CYP2C19

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 4810/4885TSHR 1438/4885CHRM2 769/4885

“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.