SCHEMBL5884564

SCHEMBL5884564

Clc1ccc(N2CCC(CCOc3ccc(C=NOCc4ccccc4)cc3)CC2)nn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
PRMT5 O14744 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
TEAD1 P28347 1/20 0.36
TEAD3 Q99594 1/20 0.36
PANK3 Q9H999 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
AMY1A P0DUB6 1/20 0.36
TSHR P16473 1/20 0.36
BCHE P06276 2/20 0.36

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
SCHEMBL5884503 0.91 DGAT1 (0.40) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL5884253 0.87 KMT2A (0.40) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL5883827 0.87 KMT2A (0.40) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL5884130 0.86 KMT2A (0.39) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL5884258 0.85 LMNA (0.36) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL5885056 0.85 LMNA (0.36) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL5884268 0.85 MEN1 (0.43) MEN1KMT2ALMNAHTTPANK3
SCHEMBL5884554 0.83 MEN1 (0.39) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL5884731 0.83 MEN1 (0.39) MEN1KMT2ALMNAHTTPANK3
SCHEMBL5884712 0.81 LMNA (0.36) MEN1KMT2AMAPTTDP1L3MBTL1

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