SCHEMBL25870743

SCHEMBL25870743

CCN1C(=O)C(=Cc2ccc(N(c3ccccc3)c3cccc4ccccc34)[se]2)C(=O)N(CC)C1=S

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 5/20 0.42
ENPP3 O14638 1/20 0.37
ALDH1A1 P00352 7/20 0.37
MAPT P10636 7/20 0.37
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
LMNA P02545 3/20 0.37
HPGD P15428 3/20 0.37
POLB P06746 3/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
HTT P42858 3/20 0.35
NTSR1 P30989 1/20 0.35
MDM2 Q00987 3/20 0.35
ALOX15 P16050 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL18863392 0.88 MAPT (0.33) TNFRSF1AALDH1A1MAPTMEN1KMT2A
SCHEMBL25870746 0.87 TNFRSF1A (0.44) TNFRSF1AENPP3ALDH1A1MAPTMEN1
SCHEMBL25870674 0.85 KMT2A (0.38) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL18863388 0.83 KDM4E (0.31) ALDH1A1MEN1KMT2AKDM4E
SCHEMBL28932832 0.82 ALDH1A1 (0.31) ALDH1A1MAPTKDM4E
SCHEMBL28705799 0.82 KDM4E (0.31) ALDH1A1KDM4E
SCHEMBL25870682 0.81 NOX4 (0.32) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL25870726 0.81 LMNA (0.34) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL18863389 0.81 SIRT2 (0.50) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL25870705 0.80 MAPT (0.32) ALDH1A1MAPTMEN1KMT2ALMNA

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
US-11711930-B2 2023-07-25 US disclosed