SCHEMBL7015744

SCHEMBL7015744

COC(=O)c1ccc(-c2ccc(OC)c(OC)c2)c(Br)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.57
PTAFR P25105 2/20 0.52
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 2/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 1/20 0.50
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
MAPK10 P53779 1/20 0.48
NOTUM Q6P988 1/20 0.48
CYP1A2 P05177 2/20 0.46
TSHR P16473 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
LMNA P02545 1/20 0.46
ATM Q13315 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45

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
SCHEMBL36283 0.81 ALDH1A1 (0.73) MAPTALDH1A1MAPK1HPGDKMT2A
SCHEMBL29810107 0.81 ALDH1A1 (0.73) MAPTALDH1A1MAPK1HPGDKMT2A
SCHEMBL29471965 0.81 EGFR (0.52) ALDH1A1MAPK1HSD17B10MAPK10NOTUM
SCHEMBL22532196 0.81 EGFR (0.52) ALDH1A1MAPK1HSD17B10MAPK10NOTUM
SCHEMBL1529177 0.81 ALDH1A1 (0.51) MAPTALDH1A1HPGDKMT2AMEN1
SCHEMBL8569127 0.80 MAPT (0.67) MAPTALDH1A1MAPK1KMT2AMEN1
Veratric Acid Methyl Ester SCHEMBL2050732 0.79 MAPT (0.86) MAPTALDH1A1KMT2AMEN1CYP1A2
Veratric Acid Methyl Ester SCHEMBL29573244 0.79 MAPT (0.86) MAPTALDH1A1KMT2AMEN1CYP1A2
SCHEMBL545133 0.78 NOTUM (0.49) MAPTALDH1A1HPGDHSD17B10KMT2A
SCHEMBL426745 0.78 MAPT (0.62) MAPTALDH1A1HPGDHSD17B10KMT2A

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
JP-2207075-A None JP disclosed
EP-0846117-B1 PROCESS FOR PREPARATION OF BIPHENYL DERIVATIVES WYETH CORP (US) 2003-05-14 EP disclosed
US-5977372-A Chloro or bromo[2-[2-(tert-butyl)-2H-tetrazol-5-yl]phenyl]zinc intermediates AMERICAN HOME PRODUCTS CORPORATION (US) 1999-11-02 US disclosed
US-5760220-A REACTING PROTECTED TETRAZOLYLPHENYL ZINC HALIDE WITH HALOPHENYLMETHYL PYRIDO/2,3-D/PYRIMIDONE IN PRESENCE OF PALLADIUM OR NICKEL CATALYST AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-02 US disclosed
JP-H02207075-A N-SUBSTITUTED-3-(SUBSTITUTED HYDRAZINO)BENZENE-SULFONAMIDE DERIVATIVE, PRODUCTION THEREOF AND HERBICIDE KUREHA CHEM IND CO LTD 1990-08-16 JP disclosed
US-4916145-A PLATELET ACTIVATING FACTOR ANTAGONISTS HOFFMANN-LA ROCHE INC. (US) 1990-04-10 US disclosed