SCHEMBL11317481

SCHEMBL11317481

CC1c2ccccc2OC1(C)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 1/20 0.38
KCNQ1 P51787 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
HTT P42858 2/20 0.37
LMNA P02545 4/20 0.35
ABCB1 P08183 1/20 0.35
HTR2B P41595 1/20 0.33
ATM Q13315 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL1963793 0.81 KCNE1 (0.36) KCNE1KCNQ1MAOAMAOBHTT
SCHEMBL17929070 0.79 KCNE1 (0.43) KCNE1KCNQ1MAOAMAOBHTT
SCHEMBL15254619 0.79 KCNE1 (0.43) KCNE1KCNQ1MAOAMAOBHTT
SCHEMBL3894061 0.76 KCNE1 (0.35) KCNE1KCNQ1MAOAMAOBHTT
SCHEMBL10435275 0.75 CHRNB2 (0.36) KCNE1KCNQ1MAOAMAOBHTT
SCHEMBL29249349 0.75 CHRNB2 (0.36) KCNE1KCNQ1MAOAMAOBHTT
Arsenic SCHEMBL8675880 0.74 LMNA (0.34) KCNE1KCNQ1MAOAMAOBHTT
SCHEMBL6204083 0.74 KCNE1 (0.38) KCNE1KCNQ1LMNAABCB1ATM
SCHEMBL18469492 0.73 LMNA (0.33) KCNE1KCNQ1MAOAMAOBHTT
SCHEMBL8800080 0.73 KCNE1 (0.37) KCNE1KCNQ1HTTLMNAABCB1

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
EP-0012096-B1 PROCESS FOR THE PREPARATION OF 2,3-DIHYDRO-2,2-DIMETHYL-7-HYDROXY-BENZOFURANE RHONE-POULENC AGROCHIMIE (FR) 1982-03-24 EP claimed
EP-0012096-A1 Process for the preparation of 2,3-dihydro-2,2-dimethyl-7-hydroxy-benzofurane RHONE-POULENC AGROCHIMIE (FR) 1980-06-11 EP claimed
EP-0012096-B1 PROCESS FOR THE PREPARATION OF 2,3-DIHYDRO-2,2-DIMETHYL-7-HYDROXY-BENZOFURANE RHONE-POULENC AGROCHIMIE (FR) 1982-03-24 EP disclosed
EP-0012096-B1 PROCESS FOR THE PREPARATION OF 2,3-DIHYDRO-2,2-DIMETHYL-7-HYDROXY-BENZOFURANE RHONE-POULENC AGROCHIMIE (FR) 1982-03-24 EP disclosed
EP-0012096-A1 Process for the preparation of 2,3-dihydro-2,2-dimethyl-7-hydroxy-benzofurane RHONE-POULENC AGROCHIMIE (FR) 1980-06-11 EP disclosed
EP-0012096-A1 Process for the preparation of 2,3-dihydro-2,2-dimethyl-7-hydroxy-benzofurane RHONE-POULENC AGROCHIMIE (FR) 1980-06-11 EP disclosed