SCHEMBL8109752

SCHEMBL8109752

Clc1ccccc1C1(Cl)C=CCC=C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
HDAC4 P56524 1/20 0.36
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
GRIN1 Q05586 4/20 0.33
GRIN2A Q12879 4/20 0.33
SLC6A4 P31645 2/20 0.33
GRIN2D O15399 2/20 0.33
GRIN3B O60391 2/20 0.33
GRIN2B Q13224 2/20 0.33
GRIN2C Q14957 2/20 0.33
GRIN3A Q8TCU5 2/20 0.33
OPRK1 P41145 1/20 0.33
OPRM1 P35372 1/20 0.33
CACNA1C Q13936 1/20 0.33
PDE7A Q13946 1/20 0.30
PDE7B Q9NP56 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL17749516 0.78 HDAC4 (0.35) LMNATSHRHDAC4CRHBPCRHR2
SCHEMBL11993802 0.69 HDAC4 (0.44) LMNATSHRHDAC4CRHBPCRHR2
SCHEMBL23116133 0.67 LMNA (0.32) LMNATSHRHDAC4CRHBPCRHR2
SCHEMBL7173890 0.66 CRHBP (0.38) HDAC4CRHBPCRHR2
SCHEMBL8940386 0.66 CRHBP (0.41) LMNATSHRHDAC4CRHBPCRHR2
SCHEMBL31506444 0.66 LMNA (0.45) LMNATSHRHDAC4CRHBPCRHR2
SCHEMBL28607882 0.64 CRHBP (0.43) LMNATSHRHDAC4CRHBPCRHR2
SCHEMBL5897472 0.62 TAAR1 (0.44) LMNATSHRHDAC4CRHBPCRHR2
SCHEMBL30344664 0.62 HDAC4 (0.43) LMNATSHRHDAC4TAAR1GRIN1
SCHEMBL1604324 0.62 HDAC4 (0.43) LMNATSHRHDAC4TAAR1GRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-54117026-A None JP disclosed
US-6160194-A Soil decontamination using ferric chelates and peroxide THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 2000-12-12 US disclosed
US-5232484-A Aqueous acid solution; mineralization; absence of large concentrations of organic solvents, chloride and sulfate THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 1993-08-03 US disclosed
JP-S54117026-A MITICIDE NIPPON SODA CO LTD 1979-09-11 JP disclosed