SCHEMBL7950138

SCHEMBL7950138

COC(=O)C(NC(=O)Cc1c(C)cc(C)cc1OC)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.44
TAS1R1 Q7RTX1 3/20 0.44
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
THRB P10828 1/20 0.41
LMNA P02545 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
LPAR1 Q92633 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL6993048 1.00 TAS1R3 (0.44) TAS1R3TAS1R1ALDH1A1SMN1; SMN2THRB
SCHEMBL9594891 0.91 TAS1R3 (0.49) TAS1R3TAS1R1ALDH1A1SMN1; SMN2THRB
SCHEMBL8744837 0.91 TAS1R3 (0.49) TAS1R3TAS1R1ALDH1A1SMN1; SMN2THRB
SCHEMBL7950079 0.90 ALDH1A1 (0.45) TAS1R3TAS1R1ALDH1A1LMNARXFP1
SCHEMBL6998473 0.90 ALDH1A1 (0.45) TAS1R3TAS1R1ALDH1A1LMNARXFP1
SCHEMBL7094315 0.90 MAPK1 (0.44) ALDH1A1THRBLMNARXFP1LPAR1
SCHEMBL7094314 0.90 MAPK1 (0.44) ALDH1A1THRBLMNARXFP1LPAR1
SCHEMBL7961970 0.87 MEN1 (0.43) TAS1R3TAS1R1LMNARXFP1LPAR1
SCHEMBL6990018 0.87 MEN1 (0.43) TAS1R3TAS1R1LMNARXFP1LPAR1
SCHEMBL7964617 0.84 TAS1R3 (0.48) TAS1R3TAS1R1ALDH1A1SMN1; SMN2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6172255-B1 INSECTICIDES; MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-01-09 US disclosed
US-5830826-A Alkoxy-alkyl-substituted 1H-3-aryl-pyrrolidine-2, 4-diones used as herbicicides and pesticides BAYER AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed