SCHEMBL9873974

SCHEMBL9873974

O=C(C(Cl)Cl)N1CCOC12CCCC2

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
CTSB P07858 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL11387535 0.98 CTSB (0.37) ALDH1A1CTSBCTSSCTSKL3MBTL1
SCHEMBL337653 0.98 CTSB (0.37) ALDH1A1CTSBCTSSCTSKL3MBTL1
SCHEMBL11403724 0.91 CTSB (0.31) ALDH1A1CTSBCTSSCTSK
SCHEMBL9874551 0.90 CTSB (0.32) ALDH1A1CTSBCTSSCTSKL3MBTL1
SCHEMBL9873835 0.90 CTSB (0.32) ALDH1A1CTSBCTSSCTSKL3MBTL1
SCHEMBL9875395 0.82 ALDH1A1 (0.39) ALDH1A1L3MBTL1
SCHEMBL5603396 0.82 CTSB (0.32) ALDH1A1CTSBCTSSCTSK
SCHEMBL11390361 0.77 ALDH1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL4069044 0.76 CTSB (0.38) ALDH1A1CTSBCTSSCTSKL3MBTL1
SCHEMBL169140 0.74 GAA (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5011526-A Combination of thiocarbamate herbicide, organophosphorus compound, antidote ICI AMERICAS INC. (US) 1991-04-30 US claimed
US-4256481-A Selective herbicide compositions NITROKEMIA IPARTELEPEK (HU) 1981-03-17 US claimed
US-5011526-A Combination of thiocarbamate herbicide, organophosphorus compound, antidote ICI AMERICAS INC. (US) 1991-04-30 US disclosed
US-4915725-A ORGANOPHOSPHORUS COMPOUNDS PROLONG THE EFFECTIVENESS OF A SINGLE APPLICATION OF THIOCARBAMATE HERBICIDE ICI AMERICAS, INC. (US) 1990-04-10 US disclosed
US-4614828-A IMPROVES SOIL PRESISTANCE OF THIOCARBAMATE HERBICIDES STAUFFER CHEMICAL CO. (US) 1986-09-30 US disclosed