SCHEMBL6511313

SCHEMBL6511313

O=C(O)Cc1cc(Cl)c(Oc2ccc3[nH]cc(S(=O)(=O)c4ccc(Cl)cc4)c3c2)c(Br)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 17/20 0.48
THRB P10828 17/20 0.48
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
CPT1A P50416 1/20 0.42
CPT1B Q92523 1/20 0.42

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
SCHEMBL6514008 0.95 SMN1; SMN2 (0.49) THRATHRBMAPTPOLBHTT
SCHEMBL6513401 0.94 THRB (0.48) THRATHRBMAPT
SCHEMBL6513939 0.94 MAPT (0.51) THRATHRBMAPTPOLBHTT
SCHEMBL6516475 0.93 THRA (0.46) THRATHRBMAPTPOLBHTT
SCHEMBL6515118 0.91 SMN1; SMN2 (0.48) THRATHRBMAPTPOLBHTT
SCHEMBL6512231 0.89 SMN1; SMN2 (0.49) THRATHRBMAPTPOLBHTT
SCHEMBL6513080 0.89 THRB (0.55) THRATHRBMAPTPOLBHTT
SCHEMBL6516000 0.87 THRB (0.56) THRATHRBMAPTPOLBHTT
SCHEMBL6512816 0.87 THRB (0.50) THRATHRBMAPT
SCHEMBL6521776 0.87 THRB (0.50) THRATHRBMAPT

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-20050032874-A1 Anticholesterol agents; arteriosclerosis BAYER AKTIENGESELLSCHAFT (DE) 2005-02-10 US disclosed
US-6794406-B2 FOR THERAPY AND PROPHYLAXIS OF ARTERIOSCLEROSIS AND HYPERCHOLESTEROLAEMIA BAYER AKTIENGESELLSCHAFT (DE) 2004-09-21 US disclosed
US-20030078288-A1 Indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2003-04-24 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 (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-20030078288-A1 Indole derivatives IDO1, IDO2, TPH2 THRA 2460/4885THRB 1772/4885MAPT 839/4885
US-20050032874-A1 Anticholesterol agents; arteriosclerosis HMGCR, CYP46A1, EBP THRA 1917/4885THRB 1835/4885MAPT 3453/4885

“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.