SCHEMBL29344323

SCHEMBL29344323

Bc1ccc2c(ccc3nc4ccccc4n32)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.36
PBRM1 Q86U86 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 9/20 0.35
ALDH1A1 P00352 7/20 0.35
HPGD P15428 5/20 0.35
GAA P10253 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPK1 P28482 1/20 0.35
MAPT P10636 4/20 0.34
HSD17B10 Q99714 3/20 0.34
LMNA P02545 3/20 0.34
TP53 P04637 2/20 0.34
CSNK1A1 P48729 1/20 0.34
CLK2 P49760 1/20 0.34
LIMK1 P53667 1/20 0.34
DYRK1A Q13627 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL31021114 0.81 SMN1; SMN2 (0.52) SMN1; SMN2PBRM1L3MBTL1KDM4EALDH1A1
SCHEMBL537413 0.81 SMN1; SMN2 (0.52) SMN1; SMN2PBRM1L3MBTL1KDM4EALDH1A1
SCHEMBL22342408 0.81 CYP2A6 (0.41) SMN1; SMN2PBRM1L3MBTL1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL29618030 0.79 HTR3A (0.41) SMN1; SMN2L3MBTL1KDM4EALDH1A1HPGD
SCHEMBL25619970 0.79 ALDH1A1 (0.43) SMN1; SMN2KDM4EALDH1A1HPGDGAA
Hydrochloric Acid SCHEMBL537827 0.79 SMN1; SMN2 (0.50) SMN1; SMN2PBRM1L3MBTL1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL537828 0.79 SMN1; SMN2 (0.50) SMN1; SMN2PBRM1L3MBTL1KDM4EALDH1A1
SCHEMBL24358467 0.75 ADORA3 (0.40) SMN1; SMN2KDM4EALDH1A1HPGDGAA
SCHEMBL22342407 0.75 ADORA3 (0.40) SMN1; SMN2KDM4EALDH1A1HPGDGAA
SCHEMBL24358457 0.75 ALDH1A1 (0.44) SMN1; SMN2KDM4EALDH1A1HPGDGAA

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
EP-3696179-B1 COMPOUND AND AN ORGANIC SEMICONDUCTING LAYER, AN ORGANIC ELECTRONIC DEVICE AND A DISPLAY OR LIGHTING DEVICE COMPRISING THE SAME NOVALED GMBH (DE) 2024-07-17 EP disclosed