SCHEMBL16506830

SCHEMBL16506830

O=c1[nH]c2c(S(=O)(=O)c3ccc(F)cc3)nnn2c2ccsc12

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 15/20 0.52
RXFP1 Q9HBX9 7/20 0.50
POLB P06746 2/20 0.50
MAPT P10636 3/20 0.49
TP53 P04637 1/20 0.41

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
SCHEMBL16506775 0.88 MAPT (0.47) HTR6RXFP1MAPT
SCHEMBL16507615 0.86 HTR6 (0.43) HTR6RXFP1POLBMAPT
SCHEMBL15285278 0.86 HTR6 (0.59) HTR6RXFP1POLBMAPTTP53
SCHEMBL16506885 0.86 THRB (0.56) HTR6RXFP1MAPTTP53
SCHEMBL16507618 0.85 HTR6 (0.46) HTR6RXFP1POLBMAPTTP53
SCHEMBL16507524 0.85 HTR6 (0.42) HTR6RXFP1POLBMAPTTP53
SCHEMBL16507185 0.81 HTR6 (0.42) HTR6RXFP1MAPTTP53
SCHEMBL15287958 0.68 MAPT (0.84) HTR6RXFP1POLBMAPTTP53
SCHEMBL15287955 0.68 HTR6 (0.58) HTR6RXFP1POLBMAPTTP53
SCHEMBL15285549 0.67 HTR6 (1.00) HTR6RXFP1POLBMAPTTP53

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-9303042-B2 Triazolothienopyrimidine compound inhibitors of urea transporters and methods of using inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-04-05 US disclosed
US-20150057274-A1 TRIAZOLOTHIENOPYRIMIDINE COMPOUND INHIBITORS OF UREA TRANSPORTERS AND METHODS OF USING INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-02-26 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-20150057274-A1 TRIAZOLOTHIENOPYRIMIDINE COMPOUND INHIBITORS OF UREA TRANSPORTERS AND METHODS OF USING INHIBITORS SLC14A1, SLC29A2, SLC29A1 HTR6 3397/4885RXFP1 1785/4885POLB 839/4885

“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.