SCHEMBL14419210

SCHEMBL14419210

CCC1=C(C)CN(C)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 3/20 0.35
MAOB P27338 3/20 0.35
DRD2 P14416 1/20 0.31
DRD1 P21728 1/20 0.31
DRD4 P21917 1/20 0.31
DRD5 P21918 1/20 0.31
DRD3 P35462 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
CHRM3 P20309 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM5 P08912 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL27249872 0.78
SCHEMBL31651703 0.76 MAOA (0.34) MAOAMAOBDRD2DRD1DRD4
SCHEMBL13896185 0.76 PNMT (0.36) MEN1ALDH1A1KMT2ACHRM3CHRM2
SCHEMBL24832453 0.75 MEN1 (0.36) MEN1ALDH1A1KMT2AMAOAMAOB
SCHEMBL23203639 0.74 MAOA (0.33) MAOAMAOBCHRM3CHRM2CHRM5
SCHEMBL23203177 0.72 MAOA (0.32) MAOAMAOB
SCHEMBL19578778 0.72 MAOA (0.43) MAOAMAOBDRD1DRD5CHRM3
SCHEMBL10842572 0.71 CYP2C19 (0.37) MEN1ALDH1A1KMT2AMAOAMAOB
SCHEMBL12616900 0.70 KDM4E (0.41) MEN1ALDH1A1KMT2ACHRM5
SCHEMBL14135414 0.69 MEN1 (0.32) MEN1ALDH1A1KMT2A

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-9181240-B2 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-11-10 US disclosed
US-20130131054-A1 TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES, INC. (US) 2013-05-23 US disclosed
US-7271173-B2 Mixed kappa/mu opioids and uses thereof THE MCLEAN HOSPITAL CORPORATION (US) 2007-09-18 US disclosed
US-7271173-B2 Mixed kappa/mu opioids and uses thereof THE MCLEAN HOSPITAL CORPORATION (US) 2007-09-18 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-20130131054-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A MEN1 2156/4885ALDH1A1 1557/4885KMT2A 434/4885

“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.