SCHEMBL14965267

SCHEMBL14965267

O=C(NCCOCC1C2CN(c3ncnc4scc(-c5ccc(F)cc5)c34)CC12)[C@@H]1CCCN1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.42
ADRB3 P13945 3/20 0.42
ADRB2 P07550 2/20 0.42
ADRB1 P08588 2/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL14965022 1.00 MEN1 (0.46) MEN1KMT2AATMSMN1; SMN2MAPT
SCHEMBL14965136 0.93 KMT2A (0.49) KMT2A
SCHEMBL14965284 0.93 KMT2A (0.49) KMT2A
SCHEMBL14965021 0.77 KMT2A (0.49) MEN1KMT2AATMMAPTADRB3
SCHEMBL14965265 0.77 KMT2A (0.49) MEN1KMT2AATMMAPTADRB3
SCHEMBL14965023 0.77 KMT2A (0.49) MEN1KMT2AATMMAPTADRB3
SCHEMBL14965291 0.76 MEN1 (0.57) MEN1KMT2AATMSMN1; SMN2MAPT
SCHEMBL14964844 0.76 MEN1 (0.57) MEN1KMT2AATMSMN1; SMN2MAPT
SCHEMBL14965250 0.72 KMT2A (0.44) KMT2AADRB3
SCHEMBL14965389 0.72 KMT2A (0.50) MEN1KMT2AATMSMN1; SMN2MAPT

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