SCHEMBL21074282

SCHEMBL21074282

Cc1cc(C)cc(N2c3cccnc3N(c3ccccc3C)C2C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MAPT P10636 2/20 0.39
TSHR P16473 2/20 0.39
MAPK1 P28482 2/20 0.39
ALOX15 P16050 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
GFER P55789 1/20 0.38
FLT3 P36888 1/20 0.33
GSK3B P49841 1/20 0.33
NPSR1 Q6W5P4 2/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL19999700 1.00 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL17831013 0.89 SMN1; SMN2 (0.37) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL19999697 0.89 SMN1; SMN2 (0.37) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL25518198 0.88 SMN1; SMN2 (0.39) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL23219313 0.87 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL19224794 0.87 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL16220760 0.87 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL12643021 0.87 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL23998675 0.87 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDTDP1MAPT
SCHEMBL19999703 0.82 ALDH1A1 (0.37) ALDH1A1KDM4EHPGDTDP1MAPT

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
EP-3492480-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-10-20 EP disclosed
EP-3492480-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2019-06-05 EP disclosed