SCHEMBL5884872

SCHEMBL5884872

C=CCON=Cc1cccc(OCCCC2CCN(c3ccc(Cl)nn3)CC2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
BPTF Q12830 1/20 0.33
GLS O94925 1/20 0.33
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA4 P43681 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
PANK3 Q9H999 2/20 0.32

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
SCHEMBL5884910 0.91 SMN1; SMN2 (0.37) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL5884901 0.91 GLS (0.33) SMN1; SMN2GLSMAOAMAOBBCHE
SCHEMBL5884712 0.90 LMNA (0.36) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL5884646 0.88 SMN1; SMN2 (0.40) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL5884914 0.87 NPY1R (0.38) SMN1; SMN2GLSMAOAMAOBBCHE
SCHEMBL5884586 0.87 SMN1; SMN2 (0.37) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL5884713 0.86 TEAD1 (0.36) SMN1; SMN2MEN1KMT2AGLSNPC1
SCHEMBL5884042 0.85 LMNA (0.42) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL5884258 0.85 LMNA (0.36) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL5884555 0.85 LMNA (0.36) SMN1; SMN2LMNAHTTMEN1KMT2A

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-7078403-B1 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2006-07-18 US claimed