SCHEMBL25824560

SCHEMBL25824560

CC(C)(C)[Si](C)(C)OCCCCOc1ccc(Oc2ccccc2N)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.49
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
IKBKB O14920 3/20 0.42
BRAF P15056 1/20 0.42
GAA P10253 2/20 0.40
RCE1 Q9Y256 1/20 0.40
ALDH1A1 P00352 2/20 0.38
PPARA Q07869 1/20 0.37
MAPT P10636 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
TLR4 O00206 1/20 0.36
LMNA P02545 1/20 0.36
ATM Q13315 1/20 0.36
PLA2G2A P14555 1/20 0.36
LCK P06239 1/20 0.35
KDR P35968 1/20 0.35
TEK Q02763 1/20 0.35

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
SCHEMBL4894524 0.83 CYP1A2 (0.56) CYP1A2CYP2C9CYP2C19GAAALDH1A1
SCHEMBL3056560 0.79 CYP1A2 (0.53) CYP1A2CYP2C9CYP2C19GAAALDH1A1
SCHEMBL20204806 0.77 MAPT (0.47) CYP1A2CYP2C9CYP2C19ALDH1A1MAPT
SCHEMBL15822750 0.73 DHFR (0.38) GAALMNA
SCHEMBL621401 0.73 CYP1A2 (0.37) CYP1A2CYP2C9CYP2C19IKBKBALDH1A1
SCHEMBL30879271 0.72 TSHR (0.59) ALDH1A1
SCHEMBL15814847 0.72 TDP1 (0.47) LTA4HGAAALDH1A1MAPTL3MBTL1
SCHEMBL621076 0.72 CYP1A2 (0.36) CYP1A2CYP2C9CYP2C19IKBKBGAA
SCHEMBL31460934 0.72 ALDH1A1 (0.66) LTA4HCYP1A2CYP2C9CYP2C19IKBKB
SCHEMBL8069572 0.72 DUT (0.39) CYP1A2CYP2C9CYP2C19

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-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed