SCHEMBL6832453

SCHEMBL6832453

O=C1CCN(c2ncnc3scc(-c4ccc(Br)cc4)c23)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.57
MEN1 O00255 8/20 0.57
LMNA P02545 5/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
HPGD P15428 2/20 0.56
AURKA O14965 1/20 0.56
AURKB Q96GD4 1/20 0.56
HTT P42858 4/20 0.54
KDM4E B2RXH2 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
MAPT P10636 3/20 0.54
ALDH1A1 P00352 2/20 0.53

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
SCHEMBL6838275 0.88 KMT2A (0.69) KMT2AMEN1LMNASMN1; SMN2HPGD
SCHEMBL6838330 0.88 LMNA (0.73) KMT2AMEN1LMNASMN1; SMN2HPGD
SCHEMBL6684027 0.84 KMT2A (0.56) KMT2AMEN1LMNASMN1; SMN2HPGD
SCHEMBL24034414 0.75 KMT2A (0.69) KMT2AMEN1LMNAHTTKDM4E
SCHEMBL17030825 0.74 KMT2A (0.67) KMT2AMEN1LMNASMN1; SMN2HPGD
SCHEMBL6836170 0.74 KMT2A (0.51) KMT2AMEN1LMNAHTTNPSR1
SCHEMBL6663592 0.73 ADRB2 (0.50) KMT2AHTT
SCHEMBL16647180 0.73 KMT2A (0.66) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL16647195 0.72 KMT2A (0.64) KMT2AMEN1LMNASMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL16636854 0.71 KMT2A (0.63) KMT2AMEN1LMNASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors XENTION LIMITED (GB) 2014-12-18 US claimed
EP-2780343-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS Xention Limited (GB) 2014-09-24 EP claimed
WO-2013072694-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LIMITED (GB) 2013-05-23 WO claimed
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2016-06-02 US disclosed
US-9290511-B2 Thieno-pyrimidines, useful as potassium channel inhibitors XENTION LIMITED (GB) 2016-03-22 US disclosed
US-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors XENTION LIMITED (GB) 2014-12-18 US disclosed
EP-2780343-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS Xention Limited (GB) 2014-09-24 EP disclosed
WO-2013072694-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LIMITED (GB) 2013-05-23 WO disclosed
US-20040138238-A1 Substituted aminopyrimidine compounds as neurokinin antagonists PREDIX PHARMACEUTICALS HOLDINGS, INC. 2004-07-15 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 (3 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-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors KCNA3, KCNJ1, KCNJ11 KMT2A 1039/4885MEN1 1141/4885LMNA 3153/4885
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS KCNA3, KCNJ1, KCNJ11 KMT2A 1025/4885MEN1 1205/4885LMNA 3254/4885
US-20040138238-A1 Substituted aminopyrimidine compounds as neurokinin antagonists TACR1, GRPR, BDKRB1 KMT2A 3337/4885MEN1 2034/4885LMNA 3508/4885

“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.