SCHEMBL6795305

SCHEMBL6795305

Cc1cc2[nH]c(C(=O)O)cc2c(C)c1Oc1ccc(O)c(S(=O)(=O)NC2CCCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 7/20 0.47
▸ THRA P10827 5/20 0.45
▸ BRD4 O60885 3/20 0.42
▸ BRD2 P25440 1/20 0.42
▸ BRD3 Q15059 1/20 0.42
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ MCOLN3 Q8TDD5 1/20 0.38
▸ HTT P42858 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ RHEB Q15382 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CASP1 P29466 1/20 0.36

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
SCHEMBL6794754 0.99 THRB (0.46) THRBTHRABRD4BRD2BRD3
SCHEMBL1642115 0.97 THRB (0.47) THRBTHRABRD4BRD2BRD3
SCHEMBL1640702 0.96 THRB (0.47) THRBTHRABRD4BRD2BRD3
SCHEMBL6270967 0.87 THRB (0.51) THRBTHRABRD4BRD2BRD3
SCHEMBL6268718 0.85 THRB (0.46) THRBTHRABRD4BRD2BRD3
SCHEMBL1642414 0.84 THRB (0.53) THRBTHRARHEB
SCHEMBL1641844 0.83 THRB (0.53) THRBTHRARHEB
SCHEMBL6271002 0.83 THRB (0.41) THRBTHRABRD4BRD2BRD3
SCHEMBL1641382 0.82 THRB (0.55) THRBTHRARHEB
SCHEMBL1641445 0.82 THRB (0.58) THRBTHRABRD4BRD2BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6723744-B2 FOR THERAPY OF OBESITY, OVERWEIGHT CONDITION, HYPERLIPIDEMIA, GLAUCOMA, CARDIAC ARRHYTHMIAS, SKIN DISORDER, THYROID DISEASE, HYPOTHYROIDISM, THYROID CANCER, DIABETES, ATHEROSCLEROSIS, HYPERTENSION, CORONARY HEART DISEASE, HYPERCHOLESTEREMIA PFIZER, INC. 2004-04-20 — — US disclosed
US-20030078289-A1 Indole carboxylic acids as thyroid receptor ligands ASPNES GARY E (US) 2003-04-24 — — US disclosed
EP-1297833-A1 Indole carboxylic acids as thyroid receptor ligands Pfizer Products Inc. (US) 2003-04-02 — — 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 (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-20030078289-A1 Indole carboxylic acids as thyroid receptor ligands THRA, MC1R, THRB THRB 3/4885THRA 1/4885BRD4 2998/4885

“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.

Send feedback