SCHEMBL13634370

SCHEMBL13634370

CCc1coc(N2CCOCC2)n1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NUDT1 P36639 1/20 0.39
AR P10275 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NPY1R P25929 2/20 0.36
KCNH2 Q12809 2/20 0.36
POLB P06746 1/20 0.36
F2RL3 Q96RI0 1/20 0.35
CXCR4 P61073 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
ELANE P08246 1/20 0.35
CYP3A4 P08684 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
SCHEMBL13634304 0.83 HRH4 (0.38) KCNH2
SCHEMBL15349077 0.83 PIK3CA (0.40) ARPOLBCXCR4ELANE
SCHEMBL13612636 0.83 HTR6 (0.44)
SCHEMBL13634305 0.79 GPR119 (0.43) MAPK1SMN1; SMN2KCNH2
SCHEMBL15348882 0.77 F2RL3 (0.37) MAPK1SMN1; SMN2KMT2AMEN1HSD17B10
SCHEMBL24375507 0.77 KMT2A (0.46) MAPK1SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL13634320 0.75 HTR3A (0.40) KCNH2
SCHEMBL13634210 0.75 HRH3 (0.33)
SCHEMBL24375918 0.74 SMN1; SMN2 (0.36) MAPK1SMN1; SMN2NUDT1KMT2AMEN1
SCHEMBL24375907 0.74 SMN1; SMN2 (0.36) MAPK1SMN1; SMN2NUDT1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed