SCHEMBL1634162

SCHEMBL1634162

O=C(Oc1ccccc1)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.72
MAPT P10636 1/20 0.72
XBP1 P17861 1/20 0.72
KDM4E B2RXH2 5/20 0.67
TP53 P04637 3/20 0.57
LMNA P02545 2/20 0.57
POLB P06746 1/20 0.57
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
P2RX7 Q99572 1/20 0.50
ALDH1A1 P00352 7/20 0.49
RECQL P46063 1/20 0.49
HPGD P15428 3/20 0.49
CNR2 P34972 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ATM Q13315 2/20 0.47
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
CYP17A1 P05093 1/20 0.46
CYP19A1 P11511 1/20 0.46

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
SCHEMBL14651295 0.90 MAPT (0.86) GAAMAPTXBP1KDM4ETP53
SCHEMBL5567915 0.89 GAA (0.58) GAAMAPTXBP1KDM4ETP53
SCHEMBL10170645 0.86 GAA (0.63) GAAMAPTXBP1KDM4ETP53
SCHEMBL5082277 0.85 MAPT (0.53) GAAMAPTXBP1KDM4ETP53
SCHEMBL5567903 0.85 GAA (0.54) GAAMAPTXBP1KDM4ETP53
SCHEMBL13004858 0.84 MAPT (0.65) GAAMAPTXBP1KDM4ETP53
SCHEMBL30924171 0.84 MAPT (0.65) GAAMAPTXBP1KDM4ETP53
SCHEMBL13255975 0.84 GAA (1.00) GAAMAPTXBP1KDM4ETP53
SCHEMBL13004855 0.82 MAPT (0.73) GAAMAPTXBP1KDM4ETP53
SCHEMBL11473992 0.82 GAA (0.68) GAAMAPTXBP1KDM4ETP53

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114890963-B Benzylidene thiazolidinedione derivative, and preparation method and application thereof 湖州师范学院 2023-05-05 CN claimed
CN-114890963-A Benzylidene thiazolidinedione derivatives, and preparation method and application thereof 湖州师范学院 2022-08-12 CN claimed
US-8378016-B2 Chemically amplified positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-19 US claimed
US-7932334-B2 Resin suitable for an acid generator SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-26 US claimed
CN-114890963-B Benzylidene thiazolidinedione derivative, and preparation method and application thereof 湖州师范学院 2023-05-05 CN disclosed
CN-114890963-A Benzylidene thiazolidinedione derivatives, and preparation method and application thereof 湖州师范学院 2022-08-12 CN disclosed
WO-2021262426-A2 ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION ARISAN THERAPEUTICS INC. (US) 2021-12-30 WO disclosed
EP-3405183-A1 ADAMATANE DERIVATIVES FOR THE TREATMENT OF FILOVIRUS INFECTION Arisan Therapeutics Inc. (US) 2018-11-28 EP disclosed
WO-2017127306-A1 ADAMATANE DERIVATIVES FOR THE TREATMENT OF FILOVIRUS INFECTION ARISAN THERAPEUTICS (US) 2017-07-27 WO disclosed