SCHEMBL10647142

SCHEMBL10647142

CCOc1ccc2c(c1)oc1cc(O)ccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
MAPT P10636 4/20 0.60
KDM4E B2RXH2 3/20 0.60
HSD17B10 Q99714 2/20 0.60
LMNA P02545 1/20 0.60
ALOX15 P16050 1/20 0.60
HTT P42858 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
MAPK1 P28482 1/20 0.58
XDH P47989 6/20 0.56
ALDH2 P05091 1/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
LTA4H P09960 1/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CYP1A2 P05177 1/20 0.47
CA4 P22748 1/20 0.47

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
SCHEMBL16809331 0.86 ALDH1A1 (0.56) ALDH1A1MAPTKDM4EHSD17B10MAPK1
SCHEMBL10649359 0.81 MAPT (0.71) ALDH1A1MAPTKDM4EHSD17B10LMNA
SCHEMBL15003206 0.79 CYP1A2 (0.62) ALDH1A1MAPTKDM4EMAPK1XDH
SCHEMBL8868179 0.79 XDH (0.77) ALDH1A1MAPTMAPK1XDHALDH2
SCHEMBL9017548 0.79 QPCT (0.61) ALDH1A1MAPTMAPK1XDHALDH2
SCHEMBL16806166 0.79 ALDH1A1 (0.54) ALDH1A1MAPTKDM4EHSD17B10SMN1; SMN2
SCHEMBL16809332 0.78 MAPT (0.68) ALDH1A1MAPTKDM4EHSD17B10LMNA
SCHEMBL3874542 0.78 KDM4E (1.00) ALDH1A1MAPTKDM4EHSD17B10LMNA
SCHEMBL29600967 0.78 KDM4E (1.00) ALDH1A1MAPTKDM4EHSD17B10LMNA
Ethoxycoumarin SCHEMBL9751650 0.77 CA9 (0.83) ALDH1A1KDM4EHSD17B10MAOAMAOB

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
EP-0155574-B1 PYRIDINIUM SALTS AND FUNGICIDES AND BACTERICIDES CONTAINING THEM BASF Aktiengesellschaft (DE) 1988-08-24 EP disclosed
EP-0094566-B1 DIBENZOFURANYLOXYALKANE-IMIDAZOLIUM SALTS, PROCESS FOR THEIR PREPARATION AND THEIR MICROBICIDAL APPLICATION BASF Aktiengesellschaft (DE) 1986-03-12 EP disclosed
EP-0155574-A1 Pyridinium salts and fungicides and bactericides containing them BASF Aktiengesellschaft (DE) 1985-09-25 EP disclosed
US-4497819-A BACTERICIDES, FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1985-02-05 US disclosed
EP-0057362-B1 DIBENZOFURANE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BASF Aktiengesellschaft (DE) 1984-06-20 EP disclosed
EP-0103277-A1 Quaternary ammonium salts of benzofuran derivatives and fungicides containing them BASF Aktiengesellschaft (DE) 1984-03-21 EP disclosed
EP-0094566-A1 Dibenzofuranyloxyalkane-imidazolium salts, process for their preparation and their microbicidal application BASF Aktiengesellschaft (DE) 1983-11-23 EP disclosed
US-4376776-A Dibenzofuran derivatives and their use for controlling fungi BASF AKTIENGESELLSCHAFT (DE) 1983-03-15 US disclosed
EP-0057362-A1 Dibenzofurane derivatives, process for their preparation and their use as fungicides BASF Aktiengesellschaft (DE) 1982-08-11 EP disclosed