SCHEMBL5884102

SCHEMBL5884102

CCON=Cc1ccc(OCCC2CCN(c3ccc(Cl)nn3)CC2)cc1O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
PPARG P37231 3/20 0.37
PPARD Q03181 3/20 0.37
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
PANK3 Q9H999 2/20 0.35
GPR119 Q8TDV5 2/20 0.35
PPARA Q07869 2/20 0.34
OPRK1 P41145 2/20 0.34
BPTF Q12830 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 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
SCHEMBL5884132 0.90 LMNA (0.39) MEN1KMT2ANPC1SMN1; SMN2PPARG
SCHEMBL5884625 0.87 MEN1 (0.39) MEN1KMT2ANPC1SMN1; SMN2PPARG
SCHEMBL5884253 0.86 KMT2A (0.40) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL5883827 0.86 KMT2A (0.40) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL5884586 0.84 SMN1; SMN2 (0.37) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL5884576 0.82 MEN1 (0.37) MEN1KMT2ASMN1; SMN2PPARGPPARD
SCHEMBL5884543 0.82 OPRK1 (0.38) MEN1KMT2ANPC1RAB9APPARG
SCHEMBL5884554 0.81 MEN1 (0.39) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL5884608 0.81 HPGD (0.40) MEN1KMT2ANPC1RAB9APPARG
SCHEMBL5884910 0.80 SMN1; SMN2 (0.37) MEN1KMT2ANPC1RAB9ASMN1; SMN2

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