SCHEMBL5863749

SCHEMBL5863749

CCNC(=O)C1(CCCCN2CCN(c3ccc4c(c3)C(=O)N(Cc3cccc(C)c3)CC4)CC2)c2ccccc2Sc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
KMT2A Q03164 2/20 0.41
TP53 P04637 2/20 0.41
DRD3 P35462 8/20 0.41
DRD2 P14416 4/20 0.41
DRD1 P21728 2/20 0.41
NPSR1 Q6W5P4 1/20 0.39
HTR1A P08908 3/20 0.37
HTR2A P28223 3/20 0.37
HTR2C P28335 3/20 0.37
KCNH2 Q12809 3/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
IDE P14735 1/20 0.36
HTT P42858 1/20 0.36
DRD4 P21917 1/20 0.36
NPBWR1 P48145 1/20 0.36
MCHR1 Q99705 1/20 0.36

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
SCHEMBL5863395 0.98 LMNA (0.43) LMNAKMT2ATP53DRD3DRD2
SCHEMBL5863263 0.94 LMNA (0.43) LMNAKMT2ATP53DRD3DRD2
SCHEMBL5864275 0.94 DRD3 (0.41) DRD3DRD2DRD1DRD4
SCHEMBL5863897 0.93 DRD3 (0.44) LMNADRD3DRD2DRD1HTR1A
SCHEMBL5864240 0.93 HTR7 (0.42) LMNAKMT2ADRD3DRD2DRD1
SCHEMBL5863901 0.93 HTR7 (0.42) LMNAKMT2ADRD3DRD2DRD1
SCHEMBL5863916 0.92 LMNA (0.42) LMNAKMT2ATP53DRD3DRD2
SCHEMBL5863642 0.92 LMNA (0.43) LMNAKMT2ATP53DRD3DRD2
SCHEMBL5864255 0.92 DRD3 (0.40) DRD3DRD2DRD1KDM4EALDH1A1
SCHEMBL5864045 0.91 DRD3 (0.51) DRD3DRD2DRD1HTR1AHTR2A

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-7030120-B2 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-18 US disclosed
US-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same OHKURA NAOTO (JP) 2004-11-11 US disclosed
US-6777414-B1 INHIBITORS OF TRIGLYCERIDE BIOSYNTHESIS AND SECRETION OF APOLIPOPROTEIN B-CONTAINING LIPOPROTEINS; ARTERIOSCLEROTIC DISEASES; HYPERLIPIDEMIA MEIJI SEIKA KAISHA, LTD. (JP) 2004-08-17 US disclosed
EP-1180514-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND BENAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2002-02-20 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-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same APOB, NCEH1, LIPC LMNA 508/4885KMT2A 2580/4885TP53 4874/4885

“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.