SCHEMBL6497782

SCHEMBL6497782

COc1ccccc1C1CCN(C(=O)C2CCc3ccccc3C(=O)C2)CC1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.67
MEN1 O00255 6/20 0.62
KMT2A Q03164 6/20 0.62
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CHRM4 P08173 3/20 0.45
CHRM1 P11229 2/20 0.45
MGLL Q99685 1/20 0.44
CHRM2 P08172 1/20 0.44
DRD2 P14416 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41

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
SCHEMBL6501091 0.86 HTR7 (0.48) HTR7MEN1KMT2AMGLL
SCHEMBL6504218 0.85 HTR7 (0.47) HTR7MEN1KMT2AALDH1A1NPSR1
SCHEMBL6075954 0.84 KMT2A (0.53) HTR7MEN1KMT2AMAPTALDH1A1
SCHEMBL6501083 0.82 HTR7 (0.46) HTR7MEN1KMT2AALDH1A1CHRM4
SCHEMBL6493038 0.82 BACE1 (0.46) HTR7
SCHEMBL6075908 0.81 KMT2A (0.48) HTR7MEN1KMT2AMAPTALDH1A1
SCHEMBL6498974 0.80 KMT2A (0.47) HTR7MEN1KMT2AMAPTALDH1A1
SCHEMBL6492092 0.80 HTR7 (1.00) HTR7MEN1KMT2ADRD2
SCHEMBL6493917 0.80 RAB9A (0.46) HTR7MAPTALDH1A1NPSR1CHRM4
Hydrochloric Acid SCHEMBL6490630 0.79 HTR7 (0.98) HTR7MEN1KMT2ADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969724-B2 Compounds SMITHKLINE BEECHAM-SPA (GB) 2005-11-29 US disclosed
US-20040024218-A1 Novel compounds SMITHKLINE BEECHAM SPA 2004-02-05 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-20040024218-A1 Novel compounds OXER1, CLIC1, CCR1 HTR7 1189/4885MEN1 3540/4885KMT2A 3155/4885

“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.