SCHEMBL6062944

SCHEMBL6062944

COc1cc(F)c(F)c(Bc2c(F)cc(F)cc2F)c1F

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 2/20 0.38
NFE2L2 Q16236 1/20 0.32
KDM1A O60341 1/20 0.31

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
SCHEMBL6062892 0.93 TUBB1 (0.36) TUBB1NFE2L2
SCHEMBL5357310 0.91 TUBB1 (0.43) TUBB1NFE2L2KDM1A
SCHEMBL6063075 0.89 TUBB1 (0.42) TUBB1NFE2L2KDM1A
SCHEMBL6063450 0.88 TAAR1 (0.37) TUBB1NFE2L2KDM1A
SCHEMBL6062355 0.86 TUBB1 (0.36) TUBB1NFE2L2
SCHEMBL6062923 0.86 TUBB1 (0.38) TUBB1KDM1A
SCHEMBL6063427 0.86 TUBB1 (0.34) TUBB1
SCHEMBL6062372 0.83 TUBB1 (0.36) TUBB1
SCHEMBL5347083 0.82 TUBB1 (0.33) TUBB1
SCHEMBL6063655 0.82 TUBB1 (0.33) 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