SCHEMBL6062858

SCHEMBL6062858

COc1cc(F)cc(F)c1Bc1c(F)ccc(C)c1F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 3/20 0.35
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
P2RX7 Q99572 1/20 0.31
TRPA1 O75762 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
SCHEMBL6063023 0.88 TUBB1 (0.38) TUBB1MEN1MAPTHTTKMT2A
SCHEMBL6062440 0.85 RAPGEF4 (0.32)
SCHEMBL5366381 0.84 TUBB1 (0.30) TUBB1
SCHEMBL5364888 0.83 TRPA1 (0.34) TUBB1MEN1MAPTHTTKMT2A
SCHEMBL6062526 0.82 TUBB1 (0.42) TUBB1HTT
SCHEMBL6063878 0.82 TRPA1 (0.33) TUBB1HTTTRPA1
SCHEMBL5347808 0.81 TUBB1 (0.30) TUBB1
SCHEMBL6062497 0.81 TUBB1 (0.40) TUBB1MEN1MAPTHTTKMT2A
SCHEMBL6062197 0.81 TUBB1 (0.33) TUBB1TRPA1
SCHEMBL6062852 0.80 TUBB1 (0.39) 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