SCHEMBL15745672

SCHEMBL15745672

CC(O)(c1cc(Cc2cc(C(C)(O)C(F)(F)F)c(N)cc2Br)c(Br)cc1N)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CFTR P13569 4/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP7 P55210 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ADRB2 P07550 2/20 0.31
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31
AR P10275 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
SCHEMBL15764637 0.83 SMN1; SMN2 (0.45) CFTRSMN1; SMN2ALDH1A1ALOX15HSD17B10
SCHEMBL15745674 0.82 ALDH1A1 (0.48) CFTRSMN1; SMN2ALDH1A1CYP1A2ALOX15
SCHEMBL15745670 0.82 CFTR (0.35) CFTRSMN1; SMN2MTNR1AMTNR1BAR
SCHEMBL15745676 0.81 SMN1; SMN2 (0.33) CFTRSMN1; SMN2MTNR1AMTNR1BAR
SCHEMBL15745678 0.81 AR (0.36) SMN1; SMN2ADRB2AR
SCHEMBL15745667 0.81 AR (0.35) CFTRSMN1; SMN2AR
SCHEMBL10002089 0.78 SMN1; SMN2 (0.42) CFTRSMN1; SMN2ALDH1A1AR
SCHEMBL15745663 0.78 AR (0.35) SMN1; SMN2AR
SCHEMBL15831665 0.77 SMN1; SMN2 (0.41) CFTRSMN1; SMN2ALDH1A1AR
SCHEMBL19465256 0.76 SMN1; SMN2 (0.42) SMN1; SMN2ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9793483-B2 Hexafluoroisopropanol group-containing diamine, polyimide and polyamide using same, cyclized product thereof, and method for producing same CENTRAL GLASS COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-20140148571-A1 Hexafluoroisopropanol Group-Containing Diamine, Polyimide And Polyamide Using Same, Cyclized Product Thereof, And Method For Producing Same CENTRAL GLASS COMPANY, LIMITED (JP) 2014-05-29 US disclosed