SCHEMBL6249581

SCHEMBL6249581

CC#CC(C)(COC)NC(=O)C(CC)Oc1cc(Cl)cc(Cl)c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
PKM P14618 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL6252988 0.91 HTRA1 (0.31) ALDH1A1
SCHEMBL6671901 0.89 HTRA1 (0.32) PKM
SCHEMBL6253709 0.87 PKM (0.32) TSHRPKMPOLBGAANPSR1
SCHEMBL6252253 0.86 NPSR1 (0.32) PKMNPSR1
SCHEMBL4616219 0.86 PKM (0.35) TSHRPKMPOLBGAANPSR1
SCHEMBL6250808 0.81 POLB (0.34) TSHRPKMPOLBGAANPSR1
SCHEMBL6671605 0.80 PKM (0.31) PKM
SCHEMBL11875470 0.79 POLB (0.38) TSHRPKMPOLBGAANPSR1
SCHEMBL4612427 0.79 GRN (0.33) ALDH1A1
SCHEMBL5158389 0.79 PKM (0.35) PKM

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-1567479-A1 FUNGICIDES Syngenta Limited (GB) 2005-08-31 EP disclosed
WO-2004048315-A1 FUNGICIDES SYNGENTA LIMITED (GB) 2004-06-10 WO disclosed