SCHEMBL15745656

SCHEMBL15745656

Cc1cc(C(C)(C)c2cc(C)c(N)c(C(C)(O)C(F)(F)F)c2)cc(C(C)(O)C(F)(F)F)c1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
AR P10275 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ESR1 P03372 1/20 0.33
HSD11B1 P28845 2/20 0.33
ALDH1A1 P00352 3/20 0.31
TSHR P16473 3/20 0.31
CYP3A4 P08684 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
TP53 P04637 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
MAPK1 P28482 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALOX15 P16050 2/20 0.31
HSD17B10 Q99714 2/20 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
SCHEMBL15745657 0.88 POLB (0.38) POLBARSMN1; SMN2ESR1HSD11B1
SCHEMBL15746915 0.86 SMN1; SMN2 (0.46) POLBARSMN1; SMN2ESR1ALDH1A1
SCHEMBL15745647 0.84 ALDH1A1 (0.46) POLBARSMN1; SMN2HSD11B1ALDH1A1
SCHEMBL15745652 0.79 AR (0.34) POLBARSMN1; SMN2ESR1ALDH1A1
SCHEMBL15745648 0.79 SMN1; SMN2 (0.34) POLBARSMN1; SMN2HSD11B1ALDH1A1
SCHEMBL15745650 0.79 AR (0.34) POLBARSMN1; SMN2ALDH1A1
SCHEMBL1816541 0.79 POLB (0.52) POLBARSMN1; SMN2HSD11B1ALDH1A1
SCHEMBL15745649 0.78 ABCC9 (0.37) POLBARSMN1; SMN2HSD11B1KDM4E
SCHEMBL15745651 0.77 HSD11B1 (0.42) HSD11B1
SCHEMBL26327918 0.77 AR (0.33) POLBARSMN1; SMN2ESR1ALDH1A1

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