SCHEMBL9629952

SCHEMBL9629952

O=C(O)C(=CF)c1cc(Br)c(Br)c(Br)c1Br

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EIF2AK2 P19525 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41

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
SCHEMBL9629950 1.00 EIF2AK2 (0.41) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL9631394 0.81 ERN1 (0.32) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL9631398 0.81 ERN1 (0.32) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL49516 0.73 EIF2AK2 (0.45) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL1668264 0.71 EIF2AK2 (0.40) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL29478355 0.69 EIF2AK2 (0.41) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL11813056 0.67 EIF2AK2 (0.39) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL4656443 0.67 EIF2AK2 (0.39) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL28387358 0.66 TDP1 (0.39) EIF2AK2CSNK2A2CSNK2BCSNK2A1
SCHEMBL38662144 0.66 EIF2AK2 (0.38) EIF2AK2CSNK2A2CSNK2BCSNK2A1

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
EP-0269821-B1 OPTICAL WAVEGUIDE HOECHST AKTIENGESELLSCHAFT (DE) 1992-04-01 EP disclosed
EP-0269821-A1 Optical waveguide HOECHST AKTIENGESELLSCHAFT (DE) 1988-06-08 EP disclosed
EP-0267459-A1 Transparent polymers HOECHST AKTIENGESELLSCHAFT (DE) 1988-05-18 EP disclosed