SCHEMBL9252402

SCHEMBL9252402

CC(O)c1c(F)c(F)c(F)c(F)c1F.NNc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL5327956 0.81 MEN1 (0.33) ALDH1A1
SCHEMBL1756535 0.81 MEN1 (0.33) ALDH1A1
SCHEMBL22129200 0.78 MEN1 (0.34) ALDH1A1
SCHEMBL187613 0.75 CA1 (0.55) CA12CA1CA2CA7CA13
Hydrochloric Acid SCHEMBL4349881 0.72 CA1 (0.52) CA12CA1CA2CA7CA13
SCHEMBL9810380 0.69 TAS1R3 (0.38)
SCHEMBL31643990 0.69 MEN1 (0.31)
SCHEMBL10585715 0.67
SCHEMBL18593300 0.67 CA1 (0.43) CA12CA1CA2CA7CA13
SCHEMBL4907726 0.66 CA1 (0.46) CA12CA1CA2CA7CA13

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-0452055-B1 Surfaces with reduced protein interactions HEWLETT PACKARD CO (US) 1995-01-11 EP disclosed