SCHEMBL5884620

SCHEMBL5884620

C=CCON=Cc1ccc(OCCC2CCN(c3ccc(Cl)nn3)CC2)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.33
BPTF Q12830 1/20 0.32
CHRNB2 P17787 2/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA4 P43681 2/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
SLC2A1 P11166 1/20 0.32
CYP1A2 P05177 1/20 0.31
HTR4 Q13639 1/20 0.31
CTSS P25774 1/20 0.31
PANK3 Q9H999 2/20 0.30

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
SCHEMBL5884228 0.92 HPGD (0.37) HPGDSLC2A1CTSS
SCHEMBL5884125 0.92 HPGD (0.37) HPGDMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL5884478 0.89 MEN1 (0.40) HPGDMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL5884258 0.86 LMNA (0.36) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL5884485 0.84 HPGD (0.38) HPGDSMN1; SMN2LMNAALDH1A1PPARG
SCHEMBL5884301 0.83 SMN1; SMN2 (0.40) HPGDMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL5884555 0.82 LMNA (0.36) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL5884902 0.82 HPGD (0.38) HPGDPPARGPPARDPPARASLC2A1
SCHEMBL5884712 0.82 LMNA (0.36) HPGDMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL5884872 0.81 SMN1; SMN2 (0.34) MEN1KMT2ASMN1; SMN2LMNAHTT

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