SCHEMBL7534140

SCHEMBL7534140

Cc1snnc1-c1ccc(Oc2ccc(Cl)c(Cl)c2)c(CCN)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 15/20 0.44
SLC6A4 P31645 15/20 0.44
KCNH2 Q12809 12/20 0.43
SOS1 Q07889 1/20 0.42
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP3A5 P20815 1/20 0.35
CYP2C19 P33261 1/20 0.35
ADRA1A P35348 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL6152401 0.85 HTR2A (0.59) HTR2ASLC6A4KCNH2
SCHEMBL7643807 0.74 HTR2A (0.44) HTR2ASLC6A4KCNH2SOS1SLC6A2
SCHEMBL7623848 0.72 SOS1 (0.43) HTR2ASLC6A4KCNH2SOS1SLC6A2
SCHEMBL6448614 0.69 HTR2A (0.67) HTR2ASLC6A4KCNH2SOS1SLC6A2
SCHEMBL6153430 0.68 HTR2A (0.59) HTR2ASLC6A4KCNH2
SCHEMBL6451017 0.67 HTR2A (0.67) HTR2ASLC6A4KCNH2ADRA1ATAAR1
SCHEMBL7521053 0.66 HTR2A (0.59) HTR2ASLC6A4KCNH2
SCHEMBL6151996 0.64 HTR2A (0.59) HTR2ASLC6A4KCNH2
SCHEMBL7568036 0.64 HTR2A (0.59) HTR2ASLC6A4KCNH2
SCHEMBL6153427 0.64 HTR2A (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020107244-A1 An antidepressant formulation consists of a biphenoxy or binaphthelenoxy compound as antidepressant, a 5-HT3 receptor antagonist and a carrier PFIZER PRODUCTS INC. 2002-08-08 US disclosed
US-20020099045-A1 Combination treatment for depression PFIZER PRODUCTS INC. 2002-07-25 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 (2 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-20020107244-A1 An antidepressant formulation consists of a biphenoxy or binaphthelenoxy compound as antidepressant, a 5-HT3 receptor antagonist and a carrier HTR3A, HTR3E, HTR4 HTR2A 11/4885SLC6A4 19/4885KCNH2 2974/4885
US-20020099045-A1 Combination treatment for depression HTR5A, HTR1A, OPRL1 HTR2A 4/4885SLC6A4 11/4885KCNH2 1516/4885

“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.