SCHEMBL9253749

SCHEMBL9253749

CC1CN(c2ccc(F)c(C(F)(F)F)c2)C(=NC(=O)C(F)(F)F)S1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
AR P10275 13/20 0.42
ACACB O00763 2/20 0.39
TAS1R3 Q7RTX0 2/20 0.36
TAS1R1 Q7RTX1 2/20 0.36
TAS1R2 Q8TE23 2/20 0.36
P2RX7 Q99572 1/20 0.34
RXRA P19793 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34

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
SCHEMBL9255706 0.90 NOTUM (0.44) NOTUMARACACBTAS1R3TAS1R1
SCHEMBL8424215 0.87 NOTUM (0.42) NOTUMARACACBTAS1R3TAS1R1
SCHEMBL8425521 0.87 NOTUM (0.42) NOTUMARACACBTAS1R3TAS1R1
SCHEMBL9085282 0.86 NOTUM (0.41) NOTUMARACACBTAS1R3TAS1R1
SCHEMBL8424641 0.85 NOTUM (0.40) NOTUMARACACBTAS1R3TAS1R1
SCHEMBL9064658 0.81 NOTUM (0.42) NOTUMACACB
SCHEMBL8425365 0.76 AR (0.46) NOTUMARTAS1R3TAS1R1TAS1R2
Hydrochloric Acid SCHEMBL9250211 0.75 AR (0.45) NOTUMARRXRAGRIN1GRIN2B
SCHEMBL9428115 0.73 NOTUM (0.41) NOTUMACACB
SCHEMBL2867424 0.72 NOTUM (0.39) NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5459277-A Iminothiazolines, their production and use as herbicides, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-10-17 US disclosed
US-5350736-A Iminothiazolines, their production and use as herbicides, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-09-27 US disclosed
EP-0529482-A1 Iminothiazolines, their production and use as herbicides, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-03 EP disclosed