SCHEMBL25870746

SCHEMBL25870746

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 5/20 0.44
ALDH1A1 P00352 9/20 0.44
MEN1 O00255 7/20 0.44
KMT2A Q03164 7/20 0.44
MAPT P10636 6/20 0.44
HPGD P15428 3/20 0.44
MAPK1 P28482 3/20 0.44
POLB P06746 3/20 0.44
LMNA P02545 2/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ENPP3 O14638 1/20 0.43
HTT P42858 4/20 0.41
ALOX15 P16050 1/20 0.41
NTSR1 P30989 1/20 0.41
MDM2 Q00987 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 1/20 0.39
THRB P10828 1/20 0.39
KDM4C Q9H3R0 1/20 0.39

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
SCHEMBL25870743 0.87 TNFRSF1A (0.42) TNFRSF1AALDH1A1MEN1KMT2AMAPT
SCHEMBL18863393 0.85 MAPT (0.40) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL25870678 0.81 MAPT (0.40) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL25870735 0.80 LMNA (0.39) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL25870688 0.80 MAPT (0.36) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL25870710 0.79 MAPT (0.37) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL25870679 0.79 EP300 (0.34) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL25870715 0.78 MAPT (0.34) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL10134151 0.78 TNFRSF1A (0.49) TNFRSF1AALDH1A1MEN1KMT2AMAPT
SCHEMBL28693064 0.78 APP (0.30)

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