SCHEMBL7047218

SCHEMBL7047218

CCN(C)C(=O)C1(CCCCN2CCN(C(=O)Cc3ccccc3)CC2)c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.49
SIGMAR1 Q99720 8/20 0.47
OPRM1 P35372 1/20 0.45
HRH2 P25021 1/20 0.44
HRH1 P35367 1/20 0.44
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL7048327 0.91 SIGMAR1 (0.49) HSD11B1SIGMAR1HRH2HRH1ALDH1A1
SCHEMBL7053024 0.86 SIGMAR1 (0.49) HSD11B1SIGMAR1HRH2HRH1ALDH1A1
SCHEMBL7613371 0.84 SIGMAR1 (0.47) HSD11B1SIGMAR1HRH2HRH1ALDH1A1
SCHEMBL27574371 0.84 SIGMAR1 (0.49) HSD11B1SIGMAR1HRH2HRH1ALDH1A1
SCHEMBL7047133 0.83 SIGMAR1 (0.50) HSD11B1SIGMAR1OPRM1HRH2HRH1
SCHEMBL7051784 0.83 SIGMAR1 (0.52) HSD11B1SIGMAR1HRH2HRH1ALDH1A1
SCHEMBL7049326 0.82 HSD11B1 (0.52) HSD11B1SIGMAR1HRH2HRH1ALDH1A1
SCHEMBL7047217 0.82 SIGMAR1 (0.48) HSD11B1SIGMAR1OPRM1HRH2HRH1
Hydrochloric Acid SCHEMBL7051147 0.81 HSD11B1 (0.51) HSD11B1SIGMAR1HRH2HRH1ALDH1A1
SCHEMBL7049635 0.81 SIGMAR1 (0.48) HSD11B1SIGMAR1OPRM1HRH2HRH1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030114442-A1 Substituted piperazine derivatives as mtp inhibitors BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-06-19 US 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-20030114442-A1 Substituted piperazine derivatives as mtp inhibitors MTTP, CETP, LIPC HSD11B1 1161/4885SIGMAR1 671/4885OPRM1 1871/4885

“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.