SCHEMBL7741836

SCHEMBL7741836

CN(C)Cc1cc(S(N)(=O)=O)ccc1Oc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 14/20 0.56
SLC6A3 Q01959 5/20 0.55
SOS1 Q07889 1/20 0.53
SLC6A2 P23975 6/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL7740500 0.84 KMT2A (0.46) SLC6A4SLC6A3SLC6A2MEN1KMT2A
SCHEMBL6947370 0.79 SLC6A4 (0.73) SLC6A4SLC6A3SOS1SLC6A2
SCHEMBL6954904 0.77 SLC6A4 (0.66) SLC6A4SLC6A3SOS1SLC6A2
SCHEMBL7221513 0.74 BRD4 (0.45) SLC6A4SLC6A3SLC6A2
Uk-390957 SCHEMBL931652 0.72 SLC6A4 (1.00) SLC6A4SLC6A3SOS1SLC6A2
SCHEMBL6947732 0.71 SLC6A4 (0.69) SLC6A4SLC6A3SOS1SLC6A2KMT2A
SCHEMBL6947359 0.71 SLC6A4 (0.69) SLC6A4SLC6A3SOS1SLC6A2
SCHEMBL6151447 0.71 SLC6A4 (1.00) SLC6A4SLC6A3SOS1SLC6A2
SCHEMBL7737267 0.71 SLC6A4 (0.75) SLC6A4SLC6A3SOS1SLC6A2
SCHEMBL930692 0.69 SLC6A4 (1.00) SLC6A4SLC6A3SOS1SLC6A2

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 34/4885SLC6A3 226/4885SOS1 2072/4885

“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.