SCHEMBL6519205

SCHEMBL6519205

O=C(O)Cc1cc(Br)c(Oc2ccc3[nH]cc(CC4CC4)c3c2)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
THRB P10828 14/20 0.47
THRA P10827 12/20 0.47
SLC6A4 P31645 1/20 0.44
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
GLA P06280 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
PMP22 Q01453 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL6533889 0.96 KDM4E (0.47) KDM4ETHRBTHRASLC6A4ALDH1A1
SCHEMBL6515683 0.96 THRB (0.49) KDM4ETHRBTHRASLC6A4
SCHEMBL6523638 0.95 THRB (0.51) KDM4ETHRBTHRASLC6A4
SCHEMBL6513243 0.93 THRB (0.50) KDM4ETHRBTHRA
SCHEMBL6516392 0.93 KDM4E (0.47) KDM4ETHRBTHRASLC6A4
SCHEMBL6513020 0.91 THRB (0.59) KDM4ETHRBTHRASLC6A4TSHR
SCHEMBL6518611 0.90 KDM4E (0.46) KDM4ETHRBTHRASLC6A4
SCHEMBL6518533 0.90 THRB (0.47) KDM4ETHRBTHRASLC6A4
SCHEMBL6515825 0.90 THRB (0.48) KDM4ETHRBTHRA
SCHEMBL6519485 0.90 THRB (0.48) KDM4ETHRBTHRA

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 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.