SCHEMBL10568192

SCHEMBL10568192

Cc1ccc(N2C(=O)CC(CI)C2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
POLB P06746 1/20 0.60
GAA P10253 1/20 0.55
HPGD P15428 1/20 0.55
ALOX12 P18054 1/20 0.55
MAPT P10636 2/20 0.54
MT-CO2 P00403 2/20 0.52
ALOX5 P09917 2/20 0.52
RECQL P46063 1/20 0.51
HTT P42858 1/20 0.50
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TSHR P16473 1/20 0.47

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
SCHEMBL10569082 0.85 MT-CO2 (0.47) ALDH1A1POLBMT-CO2ALOX5MEN1
SCHEMBL10573727 0.85 ALDH1A1 (0.62) ALDH1A1POLBGAAHPGDALOX12
SCHEMBL10572512 0.85 ALDH1A1 (0.62) ALDH1A1POLBGAAHPGDALOX12
SCHEMBL10569728 0.85 ALDH1A1 (0.62) ALDH1A1POLBGAAHPGDALOX12
SCHEMBL10570458 0.84 MT-CO2 (0.52) ALDH1A1GAAALOX12MAPTMT-CO2
SCHEMBL10570992 0.84 POLB (0.58) ALDH1A1POLBGAAHPGDALOX12
SCHEMBL10570366 0.84 ALDH1A1 (0.52) ALDH1A1POLBGAAMAPTMT-CO2
SCHEMBL10567917 0.83 MT-CO2 (0.63) ALDH1A1POLBGAAMAPTMT-CO2
SCHEMBL10569456 0.80 POLB (0.47) ALDH1A1POLBHPGDMAPTMT-CO2
SCHEMBL10567104 0.80 SLC6A2 (0.45) ALDH1A1POLBMT-CO2ALOX5MEN1

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
US-4847285-A 1-substituted phenyl-3-substituted methyl-pyrrolidine-2,5-diones and plant fungicide compositions containing same THE DOW CHEMICAL COMPANY (US) 1989-07-11 US disclosed