SCHEMBL15219458

SCHEMBL15219458

CC(C)(C)OC(=O)C1CCN(S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)OO)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.40
TP53 P04637 2/20 0.38
ALDH1A1 P00352 6/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
STS P08842 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 2/20 0.32
PKM P14618 1/20 0.31
EPHX2 P34913 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
RECQL P46063 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2618581 0.87 HRH3 (0.41) HRH3TP53ALDH1A1TSHRMAPT
SCHEMBL15326156 0.75 CA1 (0.34) ALDH1A1TSHRMEN1KMT2APOLB
SCHEMBL20599526 0.72 TP53 (0.49) HRH3TP53ALDH1A1TSHRMAPT
SCHEMBL12071827 0.71 ALDH1A1 (0.52) TP53ALDH1A1TSHRMAPTHSD17B10
SCHEMBL15681907 0.71 TP53 (0.38) TP53ALDH1A1TSHRMAPTHSD17B10
SCHEMBL18220793 0.69 TP53 (0.34) TP53ALDH1A1TSHRMAPTHSD17B10
SCHEMBL23581795 0.68 TP53 (0.46) HRH3TP53ALDH1A1TSHRMAPT
SCHEMBL12071829 0.67 TSHR (0.44) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL15082950 0.67
SCHEMBL10274867 0.66 HRH3 (0.55) HRH3TP53ALDH1A1TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013125733-A1 PATTERN FORMING METHOD, ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, MANUFACTURING METHOD OF ELECTRONIC DEVICE USING THE SAME AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2013-08-29 WO disclosed