SCHEMBL29259205

SCHEMBL29259205

CCCCCCCC=CC(CCCCC)OC(C)=O

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PDE4D Q08499 2/20 0.47
GALR3 O60755 1/20 0.47
CYP3A4 P08684 1/20 0.46
PPARG P37231 2/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44
GPR132 Q9UNW8 1/20 0.44

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
SCHEMBL500452 0.94 MEN1 (0.46) MEN1KMT2APDE4DCYP3A4TP53
SCHEMBL500451 0.94 MEN1 (0.46) MEN1KMT2APDE4DCYP3A4TP53
SCHEMBL30368256 0.94 GALR3 (0.47) MEN1KMT2APDE4DGALR3
SCHEMBL29094957 0.93 MEN1 (0.45) MEN1KMT2APDE4DGALR3CYP3A4
SCHEMBL11087291 0.92 ALDH1A1 (0.45) MEN1KMT2APDE4DGALR3CYP3A4
SCHEMBL833101 0.89 GALR3 (0.44) MEN1KMT2APDE4DGALR3
SCHEMBL830653 0.89 GALR3 (0.44) MEN1KMT2APDE4DGALR3
SCHEMBL6135354 0.89 GALR3 (0.44) MEN1KMT2APDE4DGALR3
SCHEMBL14224913 0.89 PDE4D (0.61) MEN1KMT2APDE4DTP53
SCHEMBL14224961 0.89 PDE4D (0.61) MEN1KMT2APDE4DTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119013011-A AMPK activators (CBDA) and SGLT2 inhibitors for metabolic health 雀巢产品有限公司 2024-11-22 CN claimed
CN-116981452-A Substituted resorcinol compounds for the management of aging and related disorders 雀巢产品有限公司 2023-10-31 CN claimed
CN-116761791-A Substituted resorcinol compounds as AMPK activators and uses thereof 雀巢产品有限公司 2023-09-15 CN claimed
CN-119013011-A AMPK activators (CBDA) and SGLT2 inhibitors for metabolic health 雀巢产品有限公司 2024-11-22 CN disclosed
CN-116981452-A Substituted resorcinol compounds for the management of aging and related disorders 雀巢产品有限公司 2023-10-31 CN disclosed
CN-116761791-A Substituted resorcinol compounds as AMPK activators and uses thereof 雀巢产品有限公司 2023-09-15 CN disclosed