SCHEMBL1647434

SCHEMBL1647434

COC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.63
MEN1 O00255 2/20 0.63
POLB P06746 1/20 0.61
ALDH1A1 P00352 5/20 0.59
TSHR P16473 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
RXFP1 Q9HBX9 1/20 0.54
GLA P06280 1/20 0.52

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
SCHEMBL1647823 0.91 MEN1 (0.54) KMT2AMEN1POLBALDH1A1TSHR
SCHEMBL1647314 0.90 MAPT (0.62) KMT2AMEN1POLBALDH1A1
SCHEMBL1648022 0.89 POLB (0.65) KMT2AMEN1POLBALDH1A1TSHR
SCHEMBL1647449 0.81 KMT2A (0.57) KMT2AMEN1POLB
SCHEMBL1316513 0.80 LRRK2 (0.63) KMT2AMEN1ALDH1A1
SCHEMBL6916613 0.79 LRRK2 (0.69) KMT2AMEN1POLBALDH1A1
SCHEMBL1646583 0.79 LRRK2 (0.64) KMT2AMEN1ALDH1A1TSHR
SCHEMBL1647944 0.78 MAPT (0.64) KMT2AMEN1POLBALDH1A1
SCHEMBL1646608 0.78 HPGD (0.56) KMT2AMEN1POLBALDH1A1TSHR
SCHEMBL1648571 0.78 LRRK2 (0.70) KMT2AMEN1POLBALDH1A1

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
EP-2483254-B1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2014-08-13 EP disclosed
US-8778939-B2 Compounds GLAXO GROUP LIMITED (GB) 2014-07-15 US disclosed
EP-2483254-A1 NOVEL COMPOUNDS Glaxo Group Limited (GB) 2012-08-08 EP disclosed
US-20120184553-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-07-19 US disclosed
WO-2011038572-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-04-07 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-20120184553-A1 NOVEL COMPOUNDS LRRK2, PARK7, PINK1 KMT2A 2336/4885MEN1 4102/4885POLB 1889/4885

“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.