SCHEMBL6063418

SCHEMBL6063418

COc1cc(Bc2c(F)ccc(C)c2F)c(F)cc1F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 3/20 0.38
GRM4 Q14833 1/20 0.32
LMNA P02545 2/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
ROCK2 O75116 1/20 0.30
ROCK1 Q13464 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
SCHEMBL6062381 0.88 TUBB1 (0.41) TUBB1GRM4LMNAMAPK1HTT
SCHEMBL5351574 0.83 TUBB1 (0.33) TUBB1
SCHEMBL6063137 0.82 GPR3 (0.31)
SCHEMBL5349865 0.82 TUBB1 (0.38) TUBB1LMNAMAPK1HTTRAB9A
SCHEMBL5346130 0.81 TUBB1 (0.33) TUBB1
SCHEMBL6063580 0.81 TUBB1 (0.37) TUBB1LMNAMAPK1HTTRAB9A
SCHEMBL6063350 0.80 TUBB1 (0.39) TUBB1GRM4LMNAMAPK1HTT
SCHEMBL5357118 0.80 TUBB1 (0.34) TUBB1LMNAMAPK1HTTRAB9A
SCHEMBL6062526 0.79 TUBB1 (0.42) TUBB1LMNAMAPK1HTTRAB9A
SCHEMBL6063355 0.78 TUBB1 (0.35) 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