SCHEMBL5884586

SCHEMBL5884586

CCON=Cc1cccc(OCCC2CCN(c3ccc(Cl)nn3)CC2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 4/20 0.36
RAB9A P51151 3/20 0.36
LMNA P02545 3/20 0.35
HTT P42858 2/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
BPTF Q12830 1/20 0.34
POLB P06746 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 2/20 0.33
CYP1A2 P05177 1/20 0.33
DGAT1 O75907 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
PANK3 Q9H999 2/20 0.33
GPR119 Q8TDV5 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
SCHEMBL5884910 0.96 SMN1; SMN2 (0.37) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL5884592 0.91 NPC1 (0.35) SMN1; SMN2NPC1RAB9APPARGPPARD
SCHEMBL5884751 0.91 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL5884948 0.91 MEN1 (0.39) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL5883827 0.89 KMT2A (0.40) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL5884253 0.89 KMT2A (0.40) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL5884625 0.89 MEN1 (0.39) SMN1; SMN2MEN1KMT2ANPC1LMNA
SCHEMBL5884872 0.87 SMN1; SMN2 (0.34) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL5883890 0.86 DGAT1 (0.35) SMN1; SMN2NPC1RAB9APOLBMAPK1
SCHEMBL5884646 0.86 SMN1; SMN2 (0.40) SMN1; SMN2MEN1KMT2ANPC1RAB9A

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