SCHEMBL16293256

SCHEMBL16293256

NC(=O)[C@H]1CCCN1CCN1CCN(c2ncc3c(-c4ccccc4)csc3n2)CC1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL14965315 1.00 POLB (0.44) POLBHTR1AHTR7GAATSHR
SCHEMBL16292829 0.84 LTA4H (0.41) GAALMNA
SCHEMBL14965135 0.84 LTA4H (0.41) GAALMNA
SCHEMBL14964886 0.82 SIGMAR1 (0.43) HTR1ALMNA
SCHEMBL14965237 0.72 LTA4H (0.43)
SCHEMBL30341169 0.71 LMNA (0.57) TSHRLMNAALDH1A1
SCHEMBL14964951 0.71
SCHEMBL14964887 0.69
SCHEMBL16293344 0.68
SCHEMBL14965609 0.68 ACKR3 (0.47)

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-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

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-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors KCNA3, KCNJ1, KCNJ11 POLB 3507/4885HTR1A 711/4885HTR7 1277/4885
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS KCNA3, KCNJ1, KCNJ11 POLB 3644/4885HTR1A 746/4885HTR7 1270/4885

“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.