SCHEMBL5604454

SCHEMBL5604454

CC1(C)C(C=C(Cl)Cl)C1C(C#N)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.63
ALDH1A1 P00352 2/20 0.63
LMNA P02545 2/20 0.47
ATM Q13315 2/20 0.47
ADRA2A P08913 1/20 0.47
CNR1 P21554 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PTGS1 P23219 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP2D6 P10635 1/20 0.41
ALOX5 P09917 3/20 0.39
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CCR1 P32246 1/20 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
SCHEMBL9247169 1.00 TDP1 (0.63) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL9247166 1.00 TDP1 (0.63) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL11039301 1.00 TDP1 (0.63) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL9502889 0.91 TDP1 (0.54) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL1821248 0.91 TDP1 (0.53) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL1492013 0.91 TDP1 (0.53) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL3844497 0.90 TDP1 (0.53) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL3844494 0.90 TDP1 (0.53) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL27463563 0.90 TDP1 (0.53) TDP1ALDH1A1LMNAATMADRA2A
SCHEMBL27463564 0.90 TDP1 (0.53) TDP1ALDH1A1LMNAATMADRA2A

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
US-20030186813-A1 Method for deploying a transgenic refuge MONSANTO TECHNOLOGY LLC 2003-10-02 US claimed
EP-1322165-B8 SEED TREATMENT WITH COMBINATIONS OF PYRETHRINS/PYRETHROIDS AND THIAMETHOXAM MONSANTO TECHNOLOGY LLC (US) 2007-10-03 EP disclosed
EP-1322165-A2 SEED TREATMENT WITH COMBINATIONS OF PYRETHRINS/PYRETHROIDS AND THIAMETHOXAM Monsanto Technology LLP (US) 2003-07-02 EP disclosed
EP-1322171-A2 TREATMENT OF TRANSGENIC CORN SEEDS WITH PESTICIDES Monsanto Technology LLC (US) 2003-07-02 EP disclosed
WO-2002030201-A2 SEED TREATMENT WITH COMBINATIONS OF PYRETHRINS/PYRETHROIDS AND THIAMETHOXAM MONSANTO TECHNOLOGY, LLC (US) 2002-04-18 WO disclosed
WO-2002030205-A2 TREATMENT OF TRANSGENIC CORN SEEDS WITH PESTICIDES MONSANTO TECHNOLOGY, LLC (US) 2002-04-18 WO disclosed
US-4977186-A PYRETHROID INSECTICIDE AND 3-IODO-2-PROPYNYL CARBAMATE ENHANCER TROY CHEMICAL CORPORATION (US) 1990-12-11 US disclosed