SCHEMBL5366348

SCHEMBL5366348

COc1ccc(F)c(Bc2c(F)cc(F)c(C)c2F)c1F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 4/20 0.40
LMNA P02545 2/20 0.33
MAPK1 P28482 2/20 0.33
NFE2L2 Q16236 2/20 0.33
RAB9A P51151 2/20 0.33
HTT P42858 1/20 0.33
ACHE P22303 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PTGS2 P35354 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
KDM1A O60341 2/20 0.30
PTGS1 P23219 2/20 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
SCHEMBL6063560 0.89 TUBB1 (0.41) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL6063456 0.87 TUBB1 (0.44) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL5355583 0.86 TUBB1 (0.43) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL6063832 0.85 TUBB1 (0.45) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL5359691 0.84 TUBB1 (0.35) TUBB1
SCHEMBL6062151 0.84 TUBB1 (0.38) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL5354701 0.84 TUBB1 (0.40) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL6062497 0.83 TUBB1 (0.40) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL5346510 0.83 TUBB1 (0.38) TUBB1LMNAMAPK1NFE2L2RAB9A
SCHEMBL6062545 0.82 TUBB1 (0.39) TUBB1LMNAMAPK1NFE2L2RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7217676-B2 Hydrophobization and silica for supported catalyst EXXON MOBIL CHEMICAL PATENTS INC. (US) 2007-05-15 US disclosed
US-20060264320-A1 Hydrophobization and silica for supported catalyst RODRIGUEZ GEORGE 2006-11-23 US disclosed
EP-1704171-A2 HYDROPHOBIZATION AND SILICA FOR SUPPORTED CATALYST ExxonMobil Chemical Patents Inc. (US) 2006-09-27 EP disclosed
WO-2005075526-A2 HYDROPHOBIZATION AND SILICA FOR SUPPORTED CATALYST EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-08-18 WO disclosed
US-20050159299-A1 Hydrophobization and silica for supported catalyst EXXONMOBIL CHEMICAL PATENTS INC. 2005-07-21 US disclosed