SCHEMBL6516484

SCHEMBL6516484

Cc1cc(CC(=O)O)cc(Br)c1Oc1ccc2[nH]cc(Cc3ccc(F)cc3)c2c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 12/20 0.53
THRA P10827 10/20 0.53
KDM4E B2RXH2 1/20 0.46
TSHR P16473 1/20 0.46
NR3C1 P04150 2/20 0.43
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
HTR2A P28223 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 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
SCHEMBL6512401 0.93 THRB (0.54) THRBTHRAKDM4ETSHRHTR2A
SCHEMBL6513749 0.93 THRA (0.56) THRBTHRAKDM4ETSHRPPARG
SCHEMBL6517155 0.92 KDM4E (0.48) THRBTHRAKDM4EPPARGPPARD
SCHEMBL6520144 0.91 KDM4E (0.46) THRBTHRAKDM4EPPARGPPARD
SCHEMBL6511210 0.89 THRA (0.53) THRBTHRAKDM4ETSHRPPARG
SCHEMBL6512108 0.89 THRA (0.49) THRBTHRAKDM4ETSHRNR3C1
SCHEMBL6515972 0.88 THRB (0.59) THRBTHRAKDM4ETSHRNR3C1
SCHEMBL6516405 0.88 THRA (0.64) THRBTHRAKDM4ETSHRPPARG
SCHEMBL6523679 0.85 KDM4E (0.49) THRBTHRAKDM4EPPARGPPARD
SCHEMBL6517117 0.85 KDM4E (0.53) THRBTHRAKDM4ETSHRPPARG

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 2460/4885KDM4E 1199/4885
US-20050032874-A1 Anticholesterol agents; arteriosclerosis HMGCR, CYP46A1, EBP THRB 1835/4885THRA 1917/4885KDM4E 2994/4885

“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.