SCHEMBL6063669

SCHEMBL6063669

COc1cc(F)cc(F)c1Bc1c(F)cc(F)c(OC)c1F

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PDGFRB P09619 1/20 0.31
PDGFRA P16234 1/20 0.31
TUBB1 Q9H4B7 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
SCHEMBL6063710 0.90 HTR7 (0.30)
SCHEMBL6062348 0.89 TUBB1 (0.31) ALDH1A1LMNAGAAMAPTPDGFRB
SCHEMBL6062197 0.87 TUBB1 (0.33) TUBB1
SCHEMBL5356516 0.86 PDGFRB (0.30) PDGFRBPDGFRA
SCHEMBL5364888 0.86 TRPA1 (0.34) ALDH1A1LMNAGAAMAPTTUBB1
SCHEMBL6062425 0.86 ALDH1A1 (0.30) ALDH1A1LMNAGAAMAPT
SCHEMBL6064043 0.85 ALDH1A1 (0.31) ALDH1A1LMNAGAAMAPT
SCHEMBL6063427 0.85 TUBB1 (0.34) ALDH1A1TUBB1
SCHEMBL6063878 0.84 TRPA1 (0.33) LMNATUBB1
SCHEMBL5347808 0.84 TUBB1 (0.30) TUBB1

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
US-20060264320-A1 Hydrophobization and silica for supported catalyst RODRIGUEZ GEORGE 2006-11-23 US disclosed