SCHEMBL7230384

SCHEMBL7230384

O=C(c1ccccc1)N1CCN(c2ccc3c(c2)C(=O)N(C2CCCCC2)C3)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
POLB P06746 2/20 0.50
LMNA P02545 2/20 0.46
ACACB O00763 1/20 0.46
MAPK1 P28482 2/20 0.45
USP2 O75604 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45
NAMPT P43490 1/20 0.44
C1S P09871 1/20 0.44
HSD17B10 Q99714 1/20 0.43
TMEM97 Q5BJF2 2/20 0.43
SIGMAR1 Q99720 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA2C P18825 1/20 0.43
HRH2 P25021 1/20 0.43
HRH1 P35367 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43

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
SCHEMBL7237646 0.88 ALDH1A1 (0.50) ALDH1A1KDM4EPOLBMAPK1MAPT
SCHEMBL7231273 0.85 MTR (0.44) ALDH1A1KDM4EPOLBLMNAACACB
SCHEMBL7228156 0.84 NR3C1 (0.42) ALDH1A1KDM4EPOLBLMNAACACB
SCHEMBL7228370 0.82 TMEM97 (0.43) ALDH1A1POLBACACBMAPK1TMEM97
SCHEMBL7228190 0.82 CACNA2D1 (0.43) ALDH1A1LMNAACACBMAPTNAMPT
SCHEMBL7230340 0.82 SIGMAR1 (0.64) TMEM97SIGMAR1HTR1AADRA2CHRH2
SCHEMBL7229883 0.82 PDK2 (0.44) ALDH1A1KDM4EPOLBACACBMAPK1
SCHEMBL7229396 0.80 MAPT (0.50) ALDH1A1KDM4ELMNAACACBMAPK1
SCHEMBL7229644 0.80 DRD4 (0.45) TMEM97SIGMAR1HTR1AADRA2CHRH2
SCHEMBL7237819 0.80 MTR (0.47) ALDH1A1LMNAMAPTTSHRSMN1; SMN2

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 ALDH1A1 3399/4885KDM4E 3344/4885POLB 2764/4885

“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.