SCHEMBL5448128

SCHEMBL5448128

CC(C)N(C)Cc1[c]cccc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA1A P35348 1/20 0.35
OPRK1 P41145 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 1/20 0.35
TSHR P16473 2/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
ALDH1A1 P00352 1/20 0.30
SIGMAR1 Q99720 2/20 0.30

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
SCHEMBL3301820 0.82 HDAC1 (0.32) TSHR
SCHEMBL160311 0.81 ALDH1A1 (0.46) SLC6A2HTR2ASLC6A4SLC6A3TSHR
SCHEMBL27755603 0.79 ALDH1A1 (0.44) SLC6A2HTR2ASLC6A4SLC6A3TSHR
SCHEMBL28636919 0.79 ALDH1A1 (0.44) SLC6A2HTR2ASLC6A4SLC6A3TSHR
SCHEMBL28558829 0.79 ALDH1A1 (0.44) SLC6A2HTR2ASLC6A4SLC6A3TSHR
SCHEMBL4658283 0.74 CHRNB2 (0.39) TSHRALDH1A1
SCHEMBL28094321 0.74 SMN1; SMN2 (0.41) TSHRALDH1A1
SCHEMBL5391395 0.73 ALDH1A1 (0.30) TSHRALDH1A1
SCHEMBL28750369 0.73 CHRNB2 (0.38) TSHRALDH1A1
SCHEMBL996139 0.72 HRH3 (0.39) SLC6A2SLC6A4ADRA1ASLC6A3KCNH2

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-20070072911-A1 Indoles and azaindoles as antiviral agents AVOLIO SALVATORE 2007-03-29 US disclosed
CN-1863528-A Indoles and azaindoles as antiviral agents ANGELETTI P IST RICHERCHE BIO (IT) 2006-11-15 CN disclosed
EP-1673081-A1 INDOLES AND AZAINDOLES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2006-06-28 EP disclosed
WO-2005034941-A1 INDOLES AND AZAINDOLES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2005-04-21 WO 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-20070072911-A1 Indoles and azaindoles as antiviral agents IDO1, IDO2, NAT1 ADRA2B 169/4885ADRA2C 75/4885SLC6A2 620/4885

“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.