SCHEMBL18937205

SCHEMBL18937205

C=C(OC(=N)CC)c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.38
MAOB P27338 4/20 0.38
LMNA P02545 2/20 0.37
HTR7 P34969 1/20 0.37
PTBP1 P26599 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
CASP3 P42574 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
PTPN1 P18031 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL18400815 0.81 MAOA (0.40) MAOAMAOBLMNAHTR7PTBP1
SCHEMBL10567241 0.80 CES2 (0.46) MAOAMAOBLMNAPTBP1SMN1; SMN2
SCHEMBL18809216 0.76 SMN1; SMN2 (0.41) MAOAMAOBLMNAPTBP1SMN1; SMN2
SCHEMBL3596705 0.75 MAPT (0.47) MAOAMAOBLMNAHTR7PTBP1
SCHEMBL18809600 0.74 LMNA (0.38) MAOAMAOBLMNAHTR7PTBP1
SCHEMBL18809492 0.74 LMNA (0.41) MAOAMAOBLMNAHTR7PTBP1
SCHEMBL18809051 0.74 MAOB (0.35) MAOAMAOBLMNAHTR7PTBP1
SCHEMBL24222565 0.73 MAOA (0.40) MAOAMAOBLMNAHTR7PTBP1
SCHEMBL19262505 0.72 SMN1; SMN2 (0.38) MAOAMAOBLMNAPTBP1SMN1; SMN2
SCHEMBL21169035 0.71 MAOB (0.37) MAOAMAOBLMNAHTR7PTBP1

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
EP-2560976-B9 FUROPYRIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2017-06-07 EP disclosed