SCHEMBL6515671

SCHEMBL6515671

O=C(O)Cc1cc(Cl)c(Oc2ccc3[nH]cc(C4CCC4)c3c2)c(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 10/20 0.58
THRA P10827 8/20 0.58
S1PR1 P21453 9/20 0.42
S1PR4 O95977 2/20 0.41
S1PR5 Q9H228 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
S1PR2 O95136 1/20 0.39
S1PR3 Q99500 1/20 0.39

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
SCHEMBL6511458 0.98 THRB (0.58) THRBTHRAS1PR1S1PR4S1PR5
SCHEMBL6515425 0.97 THRB (0.57) THRBTHRAS1PR1S1PR4S1PR5
SCHEMBL6520673 0.96 THRB (0.60) THRBTHRAS1PR1
SCHEMBL6513391 0.94 THRB (0.66) THRBTHRAS1PR1S1PR4S1PR5
SCHEMBL6512266 0.92 THRB (0.66) THRBTHRAS1PR1S1PR4S1PR5
SCHEMBL6515968 0.91 THRB (0.65) THRBTHRAS1PR1S1PR4S1PR5
SCHEMBL6515983 0.91 THRB (0.63) THRBTHRAMTNR1AMTNR1B
SCHEMBL6519216 0.90 THRB (0.68) THRBTHRAS1PR1S1PR4S1PR5
SCHEMBL6532322 0.90 THRB (0.58) THRBTHRAS1PR1S1PR4S1PR5
SCHEMBL6515514 0.90 THRB (0.61) THRBTHRAS1PR1S1PR4S1PR5

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 5 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
EP-1347959-A1 INDOLE DERIVATIVES AS LIGANDS OF THYROID RECEPTORS Bayer Aktiengesellschaft (DE) 2003-10-01 EP disclosed
US-20030078288-A1 Indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2003-04-24 US disclosed
WO-2002051805-A1 INDOLE DERIVATIVES AS LIGANDS OF THYROID RECEPTORS BAYER AKTIENGESELLSCHAFT (DE) 2002-07-04 WO 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 THRB 1772/4885THRA 2460/4885S1PR1 2318/4885
US-20050032874-A1 Anticholesterol agents; arteriosclerosis HMGCR, CYP46A1, EBP THRB 1835/4885THRA 1917/4885S1PR1 220/4885

“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.