SCHEMBL28048807

SCHEMBL28048807

Cc1ccc(-c2c(N)ccc3c2Sc2ccc(N)cc2S3)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.34
MAPT P10636 5/20 0.33
L3MBTL1 Q9Y468 4/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
TP53 P04637 3/20 0.33
KDM4E B2RXH2 3/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
ALDH1A1 P00352 2/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
CHRM3 P20309 1/20 0.32
SLC6A2 P23975 1/20 0.32

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
SCHEMBL28265223 0.85 KMT2A (0.36) MAPTL3MBTL1SMN1; SMN2KDM4EALDH1A1
SCHEMBL27947366 0.82 ACHE (0.32) ACHEMAPTL3MBTL1SMN1; SMN2TP53
SCHEMBL16166582 0.78
SCHEMBL28825592 0.77 PLA2G7 (0.38) MAPTL3MBTL1SMN1; SMN2TP53KDM4E
SCHEMBL10363196 0.71 MEN1 (0.45) ACHEMAPTL3MBTL1SMN1; SMN2TP53
SCHEMBL1144983 0.71 MEN1 (0.45) ACHEMAPTL3MBTL1SMN1; SMN2TP53
SCHEMBL28048870 0.70 ALDH1A1 (0.39) MAPTL3MBTL1SMN1; SMN2TP53KDM4E
SCHEMBL28405771 0.69 MEN1 (0.41) MAPTL3MBTL1ALDH1A1HSD17B10MEN1
SCHEMBL28048709 0.69 ACHE (0.39) ACHEMAPTL3MBTL1SMN1; SMN2TP53
SCHEMBL4248242 0.69 TDP1 (0.48) ACHEMAPTL3MBTL1SMN1; SMN2TP53

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
CN-105189475-A Heterocyclic compounds and their use in electro-optical or opto-electronic devices POWER OLEDS LTD 2015-12-23 CN claimed