SCHEMBL8846745

SCHEMBL8846745

CCOP(C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
LTA4H P09960 1/20 0.35
TP53 P04637 1/20 0.35
PSIP1 O75475 1/20 0.34
RELA Q04206 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KCNN4 O15554 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
HSD11B1 P28845 1/20 0.31
KCNH2 Q12809 1/20 0.31
GLA P06280 1/20 0.31
ALDH1A1 P00352 2/20 0.31
TSHR P16473 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL14597953 0.82 LMNA (0.38) CYP3A4TDP1ESR1ESR2LTA4H
Pyridine SCHEMBL11569993 0.81 KDM4E (0.33)
SCHEMBL911476 0.78 CYP3A4 (0.39) CYP3A4TDP1ESR1ESR2LTA4H
SCHEMBL196443 0.78 CYP3A4 (0.39) CYP3A4TDP1ESR1ESR2LTA4H
SCHEMBL15103402 0.76 CYP3A4 (0.38) CYP3A4TDP1ESR1ESR2LTA4H
SCHEMBL28018587 0.76 CYP3A4 (0.38) CYP3A4TDP1ESR1ESR2LTA4H
SCHEMBL11423935 0.74 CYP3A4 (0.36) CYP3A4TDP1ESR1ESR2LTA4H
SCHEMBL5738401 0.74 CYP3A4 (0.36) CYP3A4TDP1ESR1ESR2LTA4H
SCHEMBL911477 0.74 GAA (0.36) CYP3A4TDP1ESR1ESR2LTA4H
SCHEMBL10439950 0.74 CYP3A4 (0.36) CYP3A4TDP1ESR1ESR2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0644206-B1 Olefin polymerization catalyst and process for preparing polyolefin SHOWA DENKO KK (JP) 1997-12-29 EP disclosed
EP-0644206-A1 Olefin polymerization catalyst and process for preparing polyolefin SHOWA DENKO KABUSHIKI KAISHA (JP) 1995-03-22 EP disclosed
EP-0003897-B1 PHOSPHINEGOLD(I)SALTS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM SMITHKLINE BECKMAN CORPORATION (US) 1983-05-25 EP disclosed
US-4342680-A WITH AN AMINE SUBSTITUTED TRIAZINE, A PHENOL, AND AN ALKALI METAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1982-08-03 US disclosed
US-4242479-A CATALYST OF ALUMINUM TRIHALIDE, ORGANOSILOXANE COMPOUND OR ETHER, MAGNESIUM ALCOHOLATE, TITANIUM-HALOGEN AND ORGANOALUMINUM COMPOUNDS SHOWA YUKA KABUSHIKI KAISHA (JP) 1980-12-30 US disclosed
US-4187385-A TITANIUM COMPONENT COPULVERIZED WITH ORGANOALUMINUM COMPOUND AND ETHYLENE OR A-OLEFINS, PARTICLE SIZE MITSUI TOATSU CHEMICAL, INC. (JP) 1980-02-05 US disclosed
US-4180636-A MAGNESIUM HALIDE, TITANIUM COMPOUND ELECTRON DONOR COMPOUND, TRIALKYL ALUMINUM CATALYST SHOWA DENKO KABUSHIKI KAISHA (JP) 1979-12-25 US disclosed
EP-0003897-A1 Phosphinegold(I)salts, process for their preparation and compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1979-09-05 EP disclosed
US-4125540-A WITH ORGANO-PHOSPHORUS COMPOUNDS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1978-11-14 US disclosed
US-4096250-A ANTI-ARTHRITIC SMITHKLINE CORPORATION (US) 1978-06-20 US disclosed
US-4087411-A TRIOXANE, BORON FLUORIDE-TYPE CATALYST MITSUBISHI GAS CHEMICAL COMPANY, INC. (JA) 1978-05-02 US disclosed