SCHEMBL6493552

SCHEMBL6493552

CCC(=O)N1CCN(CCCCCC2=CC(=O)N(C)C2=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 1/20 0.41
▸ HRH2 P25021 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ GAA P10253 1/20 0.38
▸ SIGMAR1 Q99720 5/20 0.37
▸ HTR7 P34969 4/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ BLM P54132 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MAP1LC3B Q9GZQ8 1/20 0.34

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
SCHEMBL6488222 0.99 DRD3 (0.41) DRD3HRH2HRH1GAASIGMAR1
SCHEMBL6496563 0.78 ALDH1A1 (0.56) HRH2HRH1GAAALDH1A1
SCHEMBL6485200 0.77 KDM4E (0.41) HRH2HRH1SIGMAR1ALDH1A1
SCHEMBL6484741 0.77 KDM4E (0.41) HRH2HRH1SIGMAR1ALDH1A1
SCHEMBL6487284 0.75 KDM4E (0.41) HRH2HRH1SIGMAR1ALDH1A1
SCHEMBL4005408 0.73 ACHE (0.49) ALDH1A1
SCHEMBL18476170 0.73 HRH2 (0.54) DRD3HRH2HRH1
SCHEMBL4330983 0.71 ACHE (0.46) ALDH1A1
SCHEMBL22521105 0.71 HRH2 (0.56) DRD3HRH2HRH1HTR7HTR1A
SCHEMBL24773181 0.70 HRH2 (0.53) DRD3HRH2HRH1GAASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861432-B2 Piperazine derivatives that destabilize androgen receptors SCHERING AKTIENGESELLSCHAFT (DE) 2005-03-01 — — US claimed
US-20040009969-A1 Piperazine derivatives that destabilize androgen receptors SCHERING AG (DE) 2004-01-15 — — US claimed
US-6861432-B2 Piperazine derivatives that destabilize androgen receptors SCHERING AKTIENGESELLSCHAFT (DE) 2005-03-01 — — 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-20040009969-A1 Piperazine derivatives that destabilize androgen receptors AR, FSHR, GNRHR DRD3 657/4885HRH2 1226/4885HRH1 1108/4885

“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.

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