SCHEMBL9810380

SCHEMBL9810380

Cc1c(F)c(F)c(C(C)O)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 8/20 0.38
TAS1R1 Q7RTX1 8/20 0.38
TAS1R2 Q8TE23 8/20 0.38
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL22129200 0.88 MEN1 (0.34) MEN1KMT2A
SCHEMBL1756535 0.85 MEN1 (0.33) MEN1KMT2A
SCHEMBL5327956 0.85 MEN1 (0.33) MEN1KMT2A
SCHEMBL28730048 0.80 TAS1R3 (0.34) TAS1R3TAS1R1TAS1R2
SCHEMBL31643990 0.78 MEN1 (0.31) MEN1KMT2A
SCHEMBL9945871 0.77 TAS1R3 (0.35) TAS1R3TAS1R1TAS1R2
SCHEMBL10489243 0.76 TAS1R3 (0.32) TAS1R3TAS1R1TAS1R2
SCHEMBL10585715 0.76
SCHEMBL12912877 0.74 TAS1R3 (0.34) TAS1R3TAS1R1TAS1R2
SCHEMBL24250416 0.72 TAS1R3 (0.33) TAS1R3TAS1R1TAS1R2

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
EP-0281439-B1 ESTERS OF CYCLOPROPANECARBOXYLIC ACIDS RELATED TO PYRETHRIC ACID, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PARASITICIDES ROUSSEL-UCLAF (FR) 1991-06-12 EP claimed
US-4939172-A Novel cyclopropane carboxylates ROUSSEL UCLAF (FR) 1990-07-03 US disclosed