SCHEMBL8773777

SCHEMBL8773777

OCCCc1ccc(O)c(-c2c(Cl)ccc3[nH]nnc23)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.38
ALOX15 P16050 3/20 0.38
PRKAB2 O43741 2/20 0.35
PRKAG1 P54619 2/20 0.35
PRKAA2 P54646 2/20 0.35
PRKAA1 Q13131 2/20 0.35
PRKAG3 Q9UGI9 2/20 0.35
PRKAG2 Q9UGJ0 2/20 0.35
PRKAB1 Q9Y478 2/20 0.35
PDE3B Q13370 2/20 0.33
PDE3A Q14432 2/20 0.33
P2RY12 Q9H244 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
CHEK1 O14757 2/20 0.32
CHEK2 O96017 2/20 0.32
BACE1 P56817 3/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX5 P09917 1/20 0.31

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
SCHEMBL8773836 0.93 BACE1 (0.39) IGF1RALOX15PRKAB2PRKAG1PRKAA2
SCHEMBL8773796 0.84 FFAR1 (0.45) PRKAG1PRKAA2PRKAA1PRKAB1
SCHEMBL28639792 0.80 MET (0.31) IGF1RALOX15MAPTTLR8
SCHEMBL8847324 0.78 IDO1 (0.38) ALOX15KDM4EALDH1A1GAAMAPT
SCHEMBL11021802 0.76 TRPA1 (0.38) IGF1RALOX15CNR1CNR2KDM4E
SCHEMBL28489734 0.75 KAT8 (0.41) ALOX15CNR1CNR2KDM4EALDH1A1
SCHEMBL7129918 0.75 ESR2 (0.44) ALOX15PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL11075897 0.75 ALDH1A1 (0.37) ALOX15PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL31570221 0.75 ALDH1A1 (0.37) ALOX15PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL6064915 0.74 MEN1 (0.39) ALOX15PRKAB2PRKAG1PRKAA2PRKAA1

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
EP-0794179-A1 Process for the preparation of benzotriazole derivatives EASTMAN KODAK COMPANY (US) 1997-09-10 EP disclosed