SCHEMBL25904140

SCHEMBL25904140

COc1ccc(-c2cc3ccc(=O)[nH]c3cc2Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 3/20 0.50
PRKAG1 P54619 3/20 0.50
PRKAA2 P54646 3/20 0.50
PRKAA1 Q13131 3/20 0.50
PRKAG3 Q9UGI9 3/20 0.50
PRKAG2 Q9UGJ0 3/20 0.50
PRKAB1 Q9Y478 3/20 0.50
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
CA2 P00918 2/20 0.44
CA1 P00915 1/20 0.44
MAOB P27338 1/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAP2K1 Q02750 1/20 0.43
MAPT P10636 3/20 0.43
F11 P03951 1/20 0.43

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
SCHEMBL25904284 0.84 KDM4E (0.47) PDE3BPDE3ACA2MAOBLMNA
SCHEMBL4551905 0.80 PTGS2 (0.47) LMNAF11MEN1KMT2A
SCHEMBL15300814 0.78 MEN1 (0.54) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL1082799 0.78 MAPT (0.56) PDE3BPDE3ALMNAKDM4EALDH1A1
SCHEMBL8925407 0.78 CA1 (0.53) CA2CA1MAOBPDGFRBFLT3
SCHEMBL4552979 0.77 KDM4E (0.47) LMNAKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL24638108 0.76 F11 (0.50) CA1LMNAALDH1A1HPGDMAPT
SCHEMBL705545 0.75 KDM4E (0.59) PDE3BPDE3ACA2CA1MAOB
SCHEMBL25904148 0.74 PDE3B (0.50) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL878695 0.74 CA12 (0.59) PDE3BPDE3ACA2LMNAKDM4E

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-2023147513-A2 COMPOSITIONS OF AUTOPHAGY MODULATING AGENTS AND USES THEREOF WASHINGTON UNIVERSITY (US) 2023-08-03 WO disclosed