SCHEMBL8430906

SCHEMBL8430906

CCCCn1c(-c2cc(C)cc(C)c2)c(C(C)C)c(=O)n([Se])c1=S

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RORA P35398 2/20 0.34
RORC P51449 2/20 0.34
RORB Q92753 2/20 0.34
PGR P06401 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PDE9A O76083 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 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
SCHEMBL8427005 0.88 PDE9A (0.36) LMNAALDH1A1GAAHPGDALOX12
SCHEMBL8430941 0.82 ALDH1A1 (0.38) LMNAALDH1A1GAAHPGDALOX12
SCHEMBL8428964 0.72 L3MBTL1 (0.38) LMNAALDH1A1GAAMEN1KMT2A
SCHEMBL8426879 0.69 PGR (0.36) LMNAALDH1A1HPGDRORARORC
SCHEMBL11424517 0.65 RORA (0.39) LMNAALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL8430907 0.64 GAA (0.36) LMNAALDH1A1GAAHPGDALOX12
SCHEMBL8427006 0.60 MAPT (0.41) LMNAALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL12752179 0.60 KMT2A (0.41) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL4152333 0.57 TDP1 (0.41) ALDH1A1GAAHPGDSMN1; SMN2RORA
SCHEMBL8777494 0.57 TDP1 (0.68) ALDH1A1GAARORARORCRORB

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-5889013-A REACTING AN URACIL COMPOUND WITH N, O-BIS/TRIMETHYLSILYL/ACETAMIDE FOLLOWED BY TETRABUTYLAMMONIUM IODIDE AND CHLOROMETHYL ETHER COMPOUND AND THEN REACTING WITH ARYL SELENOL IN A BASE SUNKYONG INDUSTRIES CO., INC. (KR) 1999-03-30 US disclosed