SCHEMBL6451017

SCHEMBL6451017

COc1ccc(CCN)c(Oc2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 15/20 0.67
SLC6A4 P31645 14/20 0.67
KCNH2 Q12809 13/20 0.67
TAAR1 Q96RJ0 2/20 0.56
ADRA1A P35348 1/20 0.56
CYP1A2 P05177 1/20 0.48

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
SCHEMBL30557833 0.81 TAAR1 (0.61) HTR2ASLC6A4KCNH2TAAR1ADRA1A
SCHEMBL8747066 0.81 TAAR1 (0.66) HTR2ASLC6A4KCNH2TAAR1ADRA1A
SCHEMBL10506599 0.81 TAAR1 (0.61) HTR2ASLC6A4KCNH2TAAR1ADRA1A
SCHEMBL30207828 0.81 TAAR1 (0.66) HTR2ASLC6A4KCNH2TAAR1ADRA1A
SCHEMBL5837159 0.80 HTR2A (1.00) HTR2ASLC6A4KCNH2
SCHEMBL5837154 0.80 SLC6A4 (1.00) HTR2ASLC6A4KCNH2
SCHEMBL626051 0.80 TAAR1 (0.73) HTR2ATAAR1ADRA1ACYP1A2
SCHEMBL5498728 0.77 ADRA1A (0.56) HTR2ASLC6A4KCNH2TAAR1ADRA1A
SCHEMBL5837833 0.74 SLC6A4 (1.00) HTR2ASLC6A4KCNH2
SCHEMBL15832058 0.74 HTR2A (0.58) HTR2ASLC6A4KCNH2

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-20050059654-A1 Method for treatment of depression and anxiety disorders by combination therapy ARNERIC STEPHEN P (US) 2005-03-17 US claimed

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-20050059654-A1 Method for treatment of depression and anxiety disorders by combination therapy SLC6A2, SLC18A2, ADRA2C HTR2A 16/4885SLC6A4 4/4885KCNH2 3485/4885

“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.