SCHEMBL29612490

SCHEMBL29612490

Cc1nn(COCC[Si](C)(C)C)c2ccc(Oc3c(Cl)cc([N+](=O)[O-])cc3Cl)cc12

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
PTPN1 P18031 1/20 0.34
CNR1 P21554 3/20 0.33
ACHE P22303 3/20 0.33
CNR2 P34972 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.32
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DGAT1 O75907 1/20 0.31
HTT P42858 1/20 0.31
TP53 P04637 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
SCHEMBL28730654 1.00 MAPT (0.35) MAPTTDP1MEN1KMT2APTPN1
SCHEMBL23042371 0.89 CNR1 (0.34) MAPTTDP1MEN1KMT2APTPN1
SCHEMBL29612541 0.89 CNR2 (0.39) MAPTMEN1KMT2ACNR1ACHE
SCHEMBL28730693 0.89 CNR2 (0.39) MAPTMEN1KMT2ACNR1ACHE
SCHEMBL29612454 0.85 PTPN1 (0.34) PTPN1DGAT1
SCHEMBL23042395 0.84 MEN1 (0.33) MAPTTDP1MEN1KMT2ASMN1; SMN2
SCHEMBL23042576 0.82 PTPN1 (0.32) PTPN1DGAT1
SCHEMBL28730630 0.78 THRA (0.37) PTPN1
SCHEMBL29729400 0.78 THRA (0.37) PTPN1
SCHEMBL23042376 0.78 PKM (0.41) MAPTMEN1KMT2ASMN1; SMN2LMNA

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-4017875-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS Terns Pharmaceuticals, Inc. (US) 2022-06-29 EP disclosed
CN-114430743-A Thyroid hormone receptor beta agonist compounds 拓臻制药公司 2022-05-03 CN disclosed