SCHEMBL7517866

SCHEMBL7517866

COc1cc(C)c(C(=O)c2c(Cl)cccc2OC)c(OCCC(C)C)c1OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNB1 Q14721 2/20 0.39
L3MBTL1 Q9Y468 4/20 0.38
RAB9A P51151 3/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
HPGD P15428 2/20 0.37
KMT2A Q03164 3/20 0.37
NPC1 O15118 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPK1 P28482 1/20 0.36
TUBB4A P04350 2/20 0.36

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
SCHEMBL6150755 0.96 L3MBTL1 (0.40) KCNB1L3MBTL1RAB9AGAAMAPT
SCHEMBL7518830 0.87 L3MBTL1 (0.41) KCNB1L3MBTL1RAB9AGAAMAPT
SCHEMBL7523163 0.86 L3MBTL1 (0.40) KCNB1L3MBTL1RAB9AGAAMAPT
SCHEMBL6742658 0.85 KCNB1 (0.44) KCNB1RAB9AMAPTNPC1ALDH1A1
SCHEMBL27465752 0.83 LMNA (0.45) L3MBTL1GAAMAPTMGAMSI
SCHEMBL6150798 0.83 L3MBTL1 (0.44) KCNB1L3MBTL1RAB9AGAAMAPT
SCHEMBL6149687 0.83 RAB9A (0.42) KCNB1L3MBTL1RAB9AGAAMAPT
SCHEMBL6150070 0.82 L3MBTL1 (0.43) KCNB1L3MBTL1RAB9AGAAMAPT
SCHEMBL7517816 0.82 ADCYAP1R1 (0.46) RAB9AHPGDKMT2ANPC1MEN1
SCHEMBL6149703 0.81 L3MBTL1 (0.42) L3MBTL1RAB9AGAAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0897904-B1 Fungicidal 2-methoxybenzophenones BASF AG (DE) 2002-02-20 EP claimed
US-5945567-A Fungicidal 2-methoxybenzophenones AMERICAN CYANAMID COMPANY (US) 1999-08-31 US claimed
EP-0897904-B1 Fungicidal 2-methoxybenzophenones BASF AG (DE) 2002-02-20 EP disclosed
US-6001883-A SUBSTITUTED BENZOPHENONES OF GIVEN FORMULA, SUCH AS 6,6'-DIMETHYL-2,2',3',4'-TETRAMETHOXY-5-TRIFLUOROMETHYL-BENZOPHENONE; HIGHLY SYSTEMIC FUNGICIDES; CONTROLLING FUNGAL DISEASE SUCH AS POWDERY MILDEW IN PLANTS AMERICAN CYANAMID COMPANY (US) 1999-12-14 US disclosed
US-5945567-A Fungicidal 2-methoxybenzophenones AMERICAN CYANAMID COMPANY (US) 1999-08-31 US disclosed
US-5922905-A INTERMEDIATES FOR FUNGICIDES AMERICAN CYANAMID COMPANY (US) 1999-07-13 US disclosed
EP-0897904-A1 Fungicidal 2-methoxybenzophenones American Cyanamid Company (US) 1999-02-24 EP disclosed