SCHEMBL7037537

SCHEMBL7037537

O=S(=O)(NC1CC1)c1cc(Oc2c(Cl)cc(-c3nn[nH]n3)cc2Cl)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.56
ACLY P53396 3/20 0.40
PFKFB3 Q16875 2/20 0.38
SFRP1 Q8N474 1/20 0.38
BRD4 O60885 1/20 0.37
BRD2 P25440 1/20 0.37
BRD3 Q15059 1/20 0.37
GAA P10253 1/20 0.37
PTPN11 Q06124 1/20 0.37
PTPRCAP Q14761 1/20 0.37

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
SCHEMBL7040381 0.81 THRB (0.59) THRBACLYGAA
SCHEMBL7039572 0.81 ACLY (0.41) THRBACLY
SCHEMBL7037032 0.80 THRB (0.61) THRBGAA
SCHEMBL4964380 0.80 THRB (0.57) THRBBRD4BRD2BRD3
SCHEMBL7208159 0.80 THRB (0.57) THRBBRD4BRD2BRD3
SCHEMBL7041170 0.78 THRB (0.52) THRBBRD4BRD2BRD3
SCHEMBL6269972 0.76 THRB (0.62) THRBBRD4BRD2BRD3
SCHEMBL6216094 0.75 THRB (0.93) THRB
SCHEMBL7042656 0.74 THRB (0.49) THRBACLYGAAPTPN11PTPRCAP
SCHEMBL7040382 0.73 THRB (0.53) THRBBRD4BRD2BRD3GAA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030040535-A1 Tetrazole compounds as thyroid receptor ligands ASPNES GARY E (US) 2003-02-27 US claimed
US-6441015-B2 OBESITY, ANTIDIABETIC AGENTS, CARDIOVASCULAR DISORDERS PFIZER INC. 2002-08-27 US claimed
US-20020006946-A1 Tetrazole compounds as thyroid receptor ligands PFIZER INC. 2002-01-17 US claimed
EP-1127882-A1 Tetrazole compounds as thyroid receptor ligands Pfizer Products Inc. (US) 2001-08-29 EP claimed
US-20030040535-A1 Tetrazole compounds as thyroid receptor ligands ASPNES GARY E (US) 2003-02-27 US disclosed
US-6441015-B2 OBESITY, ANTIDIABETIC AGENTS, CARDIOVASCULAR DISORDERS PFIZER INC. 2002-08-27 US disclosed
US-20020006946-A1 Tetrazole compounds as thyroid receptor ligands PFIZER INC. 2002-01-17 US disclosed
EP-1127882-A1 Tetrazole compounds as thyroid receptor ligands Pfizer Products Inc. (US) 2001-08-29 EP 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-20030040535-A1 Tetrazole compounds as thyroid receptor ligands THRA, TSHR, THRB THRB 3/4885ACLY 3833/4885PFKFB3 1694/4885
US-20020006946-A1 Tetrazole compounds as thyroid receptor ligands TSHR, THRA, THRB THRB 3/4885ACLY 3771/4885PFKFB3 1556/4885

“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.