SCHEMBL7213113

SCHEMBL7213113

COc1cc(Br)c(OC)c2c(OC)cc(Br)c(OC)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
POLB P06746 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TSHR P16473 1/20 0.46
APOBEC3A P31941 1/20 0.46
HTT P42858 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
MAPT P10636 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
PRKDC P78527 1/20 0.43
HTR2A P28223 5/20 0.43
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
ACHE P22303 1/20 0.42
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42
TUBB1 Q9H4B7 3/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42

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
SCHEMBL3155331 0.78 CA2 (0.54) CA2CA4POLBL3MBTL1TSHR
SCHEMBL298224 0.75 POLB (0.59) POLBL3MBTL1MAPTNPSR1PRKDC
SCHEMBL369991 0.75 POLB (0.67) CA2POLBL3MBTL1MAPTNPSR1
SCHEMBL29878552 0.75 POLB (0.67) CA2POLBL3MBTL1MAPTNPSR1
SCHEMBL30697556 0.75 CA2 (0.50) CA2CA4POLBL3MBTL1TSHR
SCHEMBL17388711 0.75 CA2 (0.50) CA2CA4POLBL3MBTL1TSHR
SCHEMBL5236856 0.73 TUBB1 (0.58) CA2CA4TSHRAPOBEC3AHTT
SCHEMBL28870388 0.73 CA2 (0.67) CA2CA4POLBL3MBTL1TSHR
SCHEMBL28647762 0.73 CA2 (0.75) CA2CA4POLBL3MBTL1TSHR
SCHEMBL3747262 0.72 SMN1; SMN2 (0.54) CA2CA4POLBL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6617462-B1 Di- and tetra-methoxy-bis(2-thienyl)naphthalene monomers that can be electropolymerized to form conductive polymers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2003-09-09 US disclosed
US-6359149-B1 Bithienylnaphthalene- and bis(3,4-ethylenedioxythienyl)naphthalene-based monomers and polymers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2002-03-19 US disclosed
US-6291621-B1 FOR PRODUCING THIN FILMS AND COATINGS USEFUL IN ELECTROCHROMIC APPLICATIONS; ELECTROCONDUCTIVITY, ELECTRODES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2001-09-18 US disclosed