SCHEMBL27459557

SCHEMBL27459557

O=C(c1ccccc1)C(OS(=O)(=O)c1ccccc1)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
HSD11B1 P28845 4/20 0.36
KAT6A Q92794 3/20 0.36
LMNA P02545 2/20 0.36
CES2 O00748 1/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
PTPN1 P18031 1/20 0.35
NR1I2 O75469 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MDM2 Q00987 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL19863269 0.85 MEN1 (0.51) LMNAPTPN1ALDH1A1
SCHEMBL19863277 0.79 ALDH1A1 (0.39) CES1L3MBTL1TDP1LMNACES2
SCHEMBL19866808 0.78 FAAH (0.56) L3MBTL1HSD11B1LMNAMAPTNPSR1
SCHEMBL10709364 0.77 KMT2A (0.48) L3MBTL1TDP1HSD11B1LMNAMAPT
SCHEMBL19863256 0.76 SRC (0.41) L3MBTL1LMNAMAPTALDH1A1CYP3A4
SCHEMBL7630497 0.75 CES1 (0.44) CES1L3MBTL1TDP1LMNACES2
SCHEMBL14778900 0.74 HTR6 (0.39) L3MBTL1TDP1HSD11B1MAPTNPSR1
SCHEMBL4127451 0.74 CA1 (0.43) L3MBTL1TDP1HSD11B1MAPTNR1I2
SCHEMBL194578 0.74 ALDH1A1 (0.54) CES1L3MBTL1TDP1HSD11B1KAT6A
SCHEMBL3899100 0.72 ALDH1A1 (0.56) CES1L3MBTL1TDP1LMNACES2

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
CN-1145078-C Polymer and resist material ������ҩ��ҵ��ʽ���� 2004-04-07 CN disclosed