SCHEMBL7049217

SCHEMBL7049217

O=C(Cc1ccccc1)N1CCN(CCCCC2(C(=O)Nc3ccccc3)c3ccccc3-c3ccccc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.48
FAAH O00519 2/20 0.48
HSD11B1 P28845 1/20 0.46
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
GAA P10253 1/20 0.43
KDM4E B2RXH2 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
SCHEMBL7051784 0.89 SIGMAR1 (0.52) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL7047321 0.88 SIGMAR1 (0.48) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL7047133 0.87 SIGMAR1 (0.50) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL27574371 0.85 SIGMAR1 (0.49) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL7047217 0.85 SIGMAR1 (0.48) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL7037447 0.85 MTTP (0.56) SIGMAR1
SCHEMBL7049635 0.85 SIGMAR1 (0.48) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL7048504 0.85 MTTP (0.47) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL7049326 0.84 HSD11B1 (0.52) SIGMAR1HSD11B1ALDH1A1LMNASMN1; SMN2
SCHEMBL7053017 0.84 SIGMAR1 (0.52) SIGMAR1HSD11B1LMNASMN1; SMN2KDM4E

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 SIGMAR1 671/4885FAAH 710/4885HSD11B1 1161/4885

“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.