Sugi Predict

Sugi Predict / Compounds / SCHEMBL14997367

SCHEMBL14997367

SCHEMBL14997367

Nc1cc(Cl)ncc1CCl

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.37
▸ PIK3CD O00329 1/20 0.32
▸ LOX P28300 1/20 0.32
▸ LOXL3 P58215 1/20 0.32
▸ LOXL2 Q9Y4K0 1/20 0.32
▸ NOS3 P29474 1/20 0.31
▸ NOS1 P29475 1/20 0.31
▸ NOS2 P35228 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
SCHEMBL27030233 0.83 LOX (0.41) TDP1PIK3CDLOXLOXL3LOXL2
SCHEMBL29829879 0.83 LOX (0.41) TDP1PIK3CDLOXLOXL3LOXL2
SCHEMBL18398211 0.81 NOS3 (0.47) TDP1NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL27030986 0.81 AOC1 (0.39) TDP1PIK3CDLOXLOXL3LOXL2
SCHEMBL27635268 0.81 TDP1 (0.35) TDP1PIK3CDLOXLOXL3LOXL2
SCHEMBL25022975 0.81 TDP1 (0.35) TDP1PIK3CDLOXLOXL3LOXL2
SCHEMBL31206394 0.81 PDXK (0.41) TDP1PIK3CDLOXLOXL3LOXL2
SCHEMBL5373562 0.81 PDXK (0.41) TDP1PIK3CDLOXLOXL3LOXL2
SCHEMBL903477 0.79 RECQL (0.35) LOXLOXL3LOXL2
SCHEMBL29758580 0.77 KMT2A (0.31) LOXLOXL3LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079697-B1 MULTI-SUBSTITUTED PYRIDYL SULFOXIMINES AND THEIR USE AS INSECTICIDES DOW AGROSCIENCES LLC (US) 2013-06-05 — — EP disclosed