SCHEMBL9566809

SCHEMBL9566809

COC=C(C(=O)O)c1ccccc1C=C(F)c1csc(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 1/20 0.46
PRKCG P05129 1/20 0.46
PRKCB P05771 1/20 0.46
IL1R1 P14778 1/20 0.46
PRKCA P17252 1/20 0.46
TNFRSF1A P19438 1/20 0.46
PRKCH P24723 1/20 0.46
PRKCI P41743 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCZ Q05513 1/20 0.46
PRKCD Q05655 1/20 0.46
PRKD1 Q15139 1/20 0.46
TLR7 Q9NYK1 1/20 0.46
SHMT1 P34896 7/20 0.38
SHMT2 P34897 5/20 0.38
PTGER1 P34995 1/20 0.37
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36

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
SCHEMBL9566808 1.00 PRKD3 (0.46) PRKD3PRKCGPRKCBIL1R1PRKCA
SCHEMBL9566874 0.85 EIF4E (0.44) EIF4EMAPT
SCHEMBL9566872 0.85 EIF4E (0.44) EIF4EMAPT
SCHEMBL9709798 0.83 PRKD3 (0.40) PRKD3PRKCGPRKCBIL1R1PRKCA
SCHEMBL9029018 0.80 PDE10A (0.39) TLR7KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL9401160 0.80 PRKD3 (0.44) PRKD3PRKCGPRKCBIL1R1PRKCA
SCHEMBL9027591 0.78 PRKD3 (0.46) PRKD3PRKCGPRKCBIL1R1PRKCA
SCHEMBL9027587 0.78 PRKD3 (0.47) PRKD3PRKCGPRKCBIL1R1PRKCA
SCHEMBL9027940 0.75 MAPT (0.46) KDM4ESMN1; SMN2NPC1RAB9AMAPT
SCHEMBL9029522 0.70 KDM4E (0.34) PTGER1KDM4EMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0544587-A1 Alpha-methylene-2-vinyl-benzeneacetic acid derivatives, process for their preparation and their use as pesticides ROUSSEL UCLAF (FR) 1993-06-02 EP disclosed