SCHEMBL5357310

SCHEMBL5357310

COc1cc(F)c(F)c(Bc2c(F)c(F)cc(OC)c2F)c1F

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 4/20 0.43
KDM1A O60341 4/20 0.34
NFE2L2 Q16236 2/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
ALDH1A1 P00352 1/20 0.30
PTGES O14684 1/20 0.30
ALOX5 P09917 1/20 0.30
PTGS1 P23219 1/20 0.30
STAT3 P40763 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 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
SCHEMBL6063075 0.98 TUBB1 (0.42) TUBB1KDM1ANFE2L2LMNAMAPK1
SCHEMBL6062944 0.91 TUBB1 (0.38) TUBB1KDM1ANFE2L2
SCHEMBL6062923 0.91 TUBB1 (0.38) TUBB1KDM1AALDH1A1
SCHEMBL5351315 0.91 TUBB1 (0.38) TUBB1KDM1A
SCHEMBL6063053 0.91 TUBB1 (0.38) TUBB1KDM1AHTR2AHTR2CHTR2B
SCHEMBL6063450 0.89 TAAR1 (0.37) TUBB1KDM1ANFE2L2ALDH1A1
SCHEMBL6062207 0.89 TUBB1 (0.37) TUBB1KDM1AHTR2AHTR2CHTR2B
SCHEMBL6062413 0.89 TUBB1 (0.44) TUBB1KDM1ANFE2L2LMNAMAPK1
SCHEMBL6062892 0.88 TUBB1 (0.36) TUBB1NFE2L2
SCHEMBL6062175 0.88 TUBB1 (0.36) 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 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