SCHEMBL46053

SCHEMBL46053

CON1CCC(N)(N(C)C(=O)Cc2c(C)cccc2C)CC1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
HTT P42858 1/20 0.31
OPRK1 P41145 1/20 0.31
COMT P21964 1/20 0.31
THRB P10828 1/20 0.31
KCNH2 Q12809 1/20 0.30
SLC22A12 Q96S37 1/20 0.30
CCR5 P51681 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 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
SCHEMBL46119 0.89
SCHEMBL46114 0.88 MEN1 (0.33) ALDH1A1MEN1KMT2A
SCHEMBL46375 0.87 NPSR1 (0.31) ALDH1A1MEN1KMT2A
SCHEMBL12071745 0.86 EZH2 (0.32) ALDH1A1MEN1KMT2A
SCHEMBL46140 0.85 TSHR (0.32) SIGMAR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL46054 0.83 L3MBTL1 (0.30) L3MBTL1
SCHEMBL46060 0.83 OPRM1 (0.39) SIGMAR1OPRK1THRBKCNH2CCR5
SCHEMBL15032118 0.82 L3MBTL1 (0.40) SIGMAR1ALDH1A1MAPTL3MBTL1KCNH2
SCHEMBL12071753 0.82 P2RX7 (0.39) ALDH1A1L3MBTL1MEN1KMT2ATDP1
SCHEMBL12071744 0.81 P2RX7 (0.36) SIGMAR1ALDH1A1L3MBTL1MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011151249-A2 METHOD OF CONTROLLING NEONICOTINOID RESISTANT HEMIPTERA SYNGENTA PARTICIPATIONS AG (CH) 2011-12-08 WO disclosed
WO-2010066780-A1 SPIROHETEROCYCLIC N-OXYPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-06-17 WO disclosed