SCHEMBL25985165

SCHEMBL25985165

O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)O)c1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CYP1A2 P05177 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GLA P06280 1/20 0.40
POLB P06746 1/20 0.40
CYP2D6 P10635 1/20 0.40
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
MAPT P10636 1/20 0.36
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
MEN1 O00255 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 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
SCHEMBL382735 0.83 KMT2A (0.43) ALDH1A1HPGDKDM4EKMT2APOLB
SCHEMBL18785995 0.82 MEN1 (0.43) KMT2AHDAC1HDAC7HDAC8HDAC6
SCHEMBL25914048 0.81 KMT2A (0.41) ALDH1A1HPGDKDM4ECYP1A2KMT2A
SCHEMBL12119759 0.77 ERN1 (0.34) ALDH1A1HPGDKDM4ECYP1A2KMT2A
SCHEMBL11991276 0.74 KDM4E (0.39) ALDH1A1HPGDKDM4ECYP1A2KMT2A
SCHEMBL12119785 0.74 SLC2A1 (0.32) HPGDKDM4EKMT2AHDAC1HDAC7
SCHEMBL19042446 0.73 KMT2A (0.44) ALDH1A1HPGDKDM4EKMT2APOLB
SCHEMBL18785994 0.73 CES2 (0.41) ALDH1A1HPGDKMT2APOLBMAPT
SCHEMBL18785757 0.73 CES2 (0.43)
SCHEMBL6449936 0.73 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EKMT2AHSD17B10

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
US-20230259027-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-08-17 US disclosed