SCHEMBL15745690

SCHEMBL15745690

Cc1cc(C)c(C(C)(O)C(F)(F)F)cc1-c1cc(C(C)(O)C(F)(F)F)c(N2C(=O)c3ccc(C(=O)c4ccc5c(c4)C(=O)N(C)C5=O)cc3C2=O)cc1C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.40
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 8/20 0.35
TSHR P16473 3/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PKM P14618 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ENPP2 Q13822 1/20 0.33

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
SCHEMBL15745688 0.89 ESR1 (0.38) ESR1ESR2ALDH1A1MEN1POLB
SCHEMBL15745962 0.86 NR1H3 (0.36) ESR1ESR2ALDH1A1MEN1KMT2A
SCHEMBL15745685 0.86 ALDH1A1 (0.37) ESR1ESR2NPSR1ALDH1A1MEN1
SCHEMBL15745687 0.86 NR1H3 (0.36) ESR1ESR2ALDH1A1MEN1KMT2A
SCHEMBL15745686 0.85 ALDH1A1 (0.44) ESR1ESR2ALDH1A1POLBKDM4E
SCHEMBL15745814 0.76 APEX1 (0.36) APEX1ESR1ESR2NPSR1ALDH1A1
SCHEMBL15746934 0.74 APEX1 (0.37) APEX1ESR1ESR2NPSR1ALDH1A1
SCHEMBL15745683 0.74 ALDH1A1 (0.35) APEX1NPSR1ALDH1A1TSHRKMT2A
SCHEMBL85774 0.72 APEX1 (0.61) APEX1ESR1ESR2NPSR1ALDH1A1
SCHEMBL15831667 0.71 NR1H3 (0.36) ESR1ESR2ALDH1A1MEN1KMT2A

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