SCHEMBL22481636

SCHEMBL22481636

CC1=C(C2(c3ccccc3C)C3=C(C=CC3)Nc3ccccc32)CC=C1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
XBP1 P17861 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PDK2 Q15119 1/20 0.32
PDK4 Q16654 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CHRM2 P08172 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
KCNH2 Q12809 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL22481637 0.90 LMNA (0.37) LMNAMAPTKMT2AMEN1XBP1
SCHEMBL22481654 0.79
SCHEMBL22481653 0.78
SCHEMBL22481683 0.78 PDK2 (0.40) LMNAMAPTKMT2AMEN1XBP1
SCHEMBL22481699 0.71 LMNA (0.44) LMNAMAPTKMT2AMEN1XBP1
SCHEMBL22481744 0.66
SCHEMBL22481631 0.61 MAPT (0.39) LMNAMAPTKMT2AMEN1XBP1
SCHEMBL19563581 0.61 PDK2 (0.44) KMT2AMEN1PDK2PDK4ALDH1A1
SCHEMBL9332219 0.58 LMNA (0.54) LMNAMAPTKMT2AMEN1XBP1
SCHEMBL29815212 0.58 LMNA (0.54) LMNAMAPTKMT2AMEN1XBP1

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
WO-2020191894-A1 THERMALLY ACTIVATED DELAYED FLUORESCENT MATERIAL AND ORGANIC LIGHT-EMITTING DIODE DISPLAY DEVICE 武汉华星光电半导体显示技术有限公司 2020-10-01 WO disclosed