SCHEMBL9620236

SCHEMBL9620236

CCC(=O)C1C(=O)CC(c2cc(C)nn2C)CC1=O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.33
PDE2A O00408 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PSMB8 P28062 1/20 0.30
PSMB9 P28065 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL10523735 0.80
SCHEMBL10523728 0.80
SCHEMBL9181720 0.76 NLRP3 (0.30)
SCHEMBL9620281 0.76 HCAR2 (0.47) SMN1; SMN2LMNAKMT2A
SCHEMBL9620342 0.75
SCHEMBL9620340 0.75
SCHEMBL9620335 0.75
SCHEMBL9173112 0.73 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL9620389 0.72 ALDH1A1 (0.38) SMN1; SMN2TSHRLMNAMEN1KMT2A
SCHEMBL18403238 0.71 SMN1; SMN2 (0.37) SMN1; SMN2TSHRLMNAPDE2AMEN1

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
EP-0292122-B1 CYCLOHEXADIONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND SELECTIVE HERBICIDAL COMPOSITIONS AS WELL AS HERBICIDAL METHOD NIHON NOHYAKU CO., LTD. (JP) 1992-01-08 EP claimed
EP-0292122-A1 Cyclohexadione derivatives, process for preparing the same and selective herbicidal compositions as well as herbicidal method NIHON NOHYAKU CO., LTD. (JP) 1988-11-23 EP claimed
EP-0292122-B1 CYCLOHEXADIONE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND SELECTIVE HERBICIDAL COMPOSITIONS AS WELL AS HERBICIDAL METHOD NIHON NOHYAKU CO., LTD. (JP) 1992-01-08 EP disclosed
US-4863504-A PLANT GROWTH REGULATORS NIHON NOHYAKU CO., LTD. (JP) 1989-09-05 US disclosed
EP-0292122-A1 Cyclohexadione derivatives, process for preparing the same and selective herbicidal compositions as well as herbicidal method NIHON NOHYAKU CO., LTD. (JP) 1988-11-23 EP disclosed