SCHEMBL14965185

SCHEMBL14965185

O=C(Nc1nc(N2C3CCC2CC(O)C3)nc2scc(-c3ccccc3Cl)c12)C1CCNC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL14965054 0.90 PIK3CA (0.36) ESR1
SCHEMBL14965080 0.87 PTK2 (0.37)
SCHEMBL14965382 0.86 PTK2 (0.38)
SCHEMBL14964954 0.76 PTK2 (0.34)
SCHEMBL14965003 0.75 ADORA3 (0.37)
SCHEMBL14965601 0.73
SCHEMBL14965062 0.71 PTK2 (0.40)
SCHEMBL14965205 0.68 ESR1 (0.39) ESR1
SCHEMBL14965112 0.68 ALDH1A1 (0.38) ALDH1A1HTTKMT2A
SCHEMBL14965320 0.67 PTK2 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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