SCHEMBL7735932

SCHEMBL7735932

CNCc1cc(S(N)(=O)=O)ccc1Oc1ccc(C)c(C)c1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 0.63
HTR2A P28223 11/20 0.63
KCNH2 Q12809 9/20 0.63
SOS1 Q07889 2/20 0.48
SLC6A3 Q01959 2/20 0.47
SLC6A2 P23975 1/20 0.45

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
SCHEMBL7741889 0.89 SLC6A4 (0.57) SLC6A4HTR2AKCNH2SOS1
SCHEMBL3361902 0.87 SLC6A4 (0.76) SLC6A4HTR2AKCNH2SOS1SLC6A3
SCHEMBL8365604 0.87 SLC6A4 (0.52) SLC6A4HTR2AKCNH2SOS1SLC6A3
SCHEMBL7740496 0.86 SLC6A4 (0.51) SLC6A4HTR2AKCNH2SOS1SLC6A3
SCHEMBL7970315 0.84 SLC6A4 (0.56) SLC6A4HTR2AKCNH2SOS1SLC6A3
SCHEMBL15080486 0.81 SLC6A4 (0.72) SLC6A4HTR2AKCNH2SLC6A3SLC6A2
SCHEMBL6152231 0.80 SLC6A4 (0.57) SLC6A4HTR2AKCNH2SOS1SLC6A3
SCHEMBL7741453 0.79 SLC6A4 (0.59) SLC6A4HTR2AKCNH2SOS1SLC6A3
SCHEMBL7067210 0.78 SLC6A4 (0.54) SLC6A4HTR2AKCNH2SOS1SLC6A3
SCHEMBL7065184 0.78 SLC6A4 (0.48) SLC6A4HTR2AKCNH2SOS1SLC6A3

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-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-01-14 US disclosed
US-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-01-14 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-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES HTR1A, HTR3B, HTR3A SLC6A4 34/4885HTR2A 10/4885KCNH2 1523/4885

“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.