SCHEMBL6517155

SCHEMBL6517155

Cc1cc(CC(=O)O)cc(Br)c1Oc1ccc2[nH]cc(Cc3ccccc3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
THRB P10828 14/20 0.46
THRA P10827 13/20 0.46
PPARG P37231 1/20 0.44
PPARD Q03181 1/20 0.44
PPARA Q07869 1/20 0.44
LTA4H P09960 1/20 0.43
PLA2G2A P14555 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41

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
SCHEMBL6517117 0.93 KDM4E (0.53) KDM4ETHRBTHRAPPARGPPARD
SCHEMBL6860893 0.93 THRB (0.53) KDM4ETHRBTHRALTA4HPLA2G2A
SCHEMBL6516484 0.92 THRB (0.53) KDM4ETHRBTHRAPPARGPPARD
SCHEMBL6520144 0.92 KDM4E (0.46) KDM4ETHRBTHRAPPARGPPARD
SCHEMBL6516144 0.89 THRB (0.51) KDM4ETHRBTHRA
SCHEMBL6518464 0.89 KDM4E (0.48) KDM4ETHRBTHRAPPARGPPARD
SCHEMBL6523679 0.87 KDM4E (0.49) KDM4ETHRBTHRAPPARGPPARD
SCHEMBL6512855 0.86 THRB (0.51) KDM4ETHRBTHRAPPARGPPARD
SCHEMBL6520865 0.86 THRB (0.60) KDM4ETHRBTHRA
SCHEMBL6515914 0.86 THRA (0.62) KDM4ETHRBTHRAPPARGPPARD

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 KDM4E 1199/4885THRB 1772/4885THRA 2460/4885
US-20050032874-A1 Anticholesterol agents; arteriosclerosis HMGCR, CYP46A1, EBP KDM4E 2994/4885THRB 1835/4885THRA 1917/4885

“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.