SCHEMBL4484703

SCHEMBL4484703

COc1ccc2cc(C(=O)O)c(NCc3ccc(NS(=O)(=O)c4ccc(C)cc4)cc3)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
LMNA P02545 2/20 0.47
GFER P55789 1/20 0.46
MAPT P10636 3/20 0.45
TP53 P04637 1/20 0.45
ALDH1A1 P00352 4/20 0.45
GAA P10253 1/20 0.45
NAMPT P43490 2/20 0.44
MEN1 O00255 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
PLAU P00749 2/20 0.43
AR P10275 1/20 0.43
AVPR2 P30518 1/20 0.43
GPR27 Q9NS67 1/20 0.43

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
SCHEMBL4477510 0.89 KDM4E (0.47) POLBMAPTTP53ALDH1A1GAA
SCHEMBL4491139 0.84 CA1 (0.52) ALDH1A1HPGD
SCHEMBL4487073 0.83 KDM4E (0.53) POLBMAPTTP53ALDH1A1GAA
SCHEMBL4487160 0.81 HPGDS (0.47) POLBMAPTALDH1A1HPGD
SCHEMBL4489260 0.80 HPGDS (0.55) LMNAMAPTTP53ALDH1A1HPGD
SCHEMBL4490500 0.80 CTNNB1 (0.51) POLBLMNAMAPTMEN1KMT2A
SCHEMBL4482149 0.80 KDM4E (0.47) MAPTMEN1KMT2A
SCHEMBL4489494 0.79 HIF1A (0.60) POLBLMNAMAPTTP53ALDH1A1
SCHEMBL4484614 0.79 KDM4E (0.46) LMNAMAPTTP53ALDH1A1MEN1
SCHEMBL4492223 0.78 CCR9 (0.47) LMNAMAPTALDH1A1MEN1KMT2A

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7482455-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-01-27 US claimed
EP-1556379-A4 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-06-13 EP claimed
US-20060106058-A1 Chemical compounds BURGESS JOELLE L 2006-05-18 US claimed
EP-1556379-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2005-07-27 EP claimed
WO-2004034985-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-04-29 WO claimed
US-7482455-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-01-27 US disclosed
EP-1556379-A4 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2007-06-13 EP disclosed
US-20060106058-A1 Chemical compounds BURGESS JOELLE L 2006-05-18 US disclosed
EP-1556379-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2005-07-27 EP disclosed
WO-2004034985-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-04-29 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 (1 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-20060106058-A1 Chemical compounds YARS1, DAPK3, NEK3 POLB 2602/4885LMNA 2030/4885GFER 4561/4885

“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.