SCHEMBL17414109

SCHEMBL17414109

CC(=O)c1ccc(S(=O)(=O)c2ccc(C(C)=O)c(C(C)=O)c2)cc1C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.45
▸ POLB P06746 4/20 0.45
▸ PKM P14618 4/20 0.45
▸ APEX1 P27695 1/20 0.45
▸ CTDSP1 Q9GZU7 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ MAPK1 P28482 3/20 0.42
▸ GAA P10253 3/20 0.42
▸ TSHR P16473 1/20 0.42
▸ LMNA P02545 4/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HTR6 P50406 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38

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
SCHEMBL17637941 0.92 APEX1 (0.55) MAPTPOLBPKMAPEX1CTDSP1
SCHEMBL14140626 0.90 APEX1 (0.58) MAPTPOLBPKMAPEX1CTDSP1
SCHEMBL18217887 0.87 LMNA (0.55) MAPTGAALMNAKMT2AALDH1A1
SCHEMBL10000040 0.86 POLB (0.37) MAPTPOLBPKMAPEX1CTDSP1
SCHEMBL21184203 0.78 LMNA (0.64) POLBAPEX1CTDSP1L3MBTL1MAPK1
SCHEMBL3148846 0.78 ALDH1A1 (0.50) MAPTPOLBL3MBTL1MAPK1GAA
SCHEMBL1397921 0.77 APEX1 (0.67) MAPTPOLBAPEX1CTDSP1L3MBTL1
SCHEMBL29364883 0.77 APEX1 (0.67) MAPTPOLBAPEX1CTDSP1L3MBTL1
SCHEMBL65212 0.77 APEX1 (0.67) MAPTPOLBAPEX1CTDSP1L3MBTL1
SCHEMBL29394064 0.77 APEX1 (0.67) MAPTPOLBAPEX1CTDSP1L3MBTL1

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-20160001528-A1 ELECTRICAL COMPONENT DENSO CORPORATION (JP) 2016-01-07 — — US disclosed
US-20160001528-A1 ELECTRICAL COMPONENT DENSO CORPORATION (JP) 2016-01-07 — — US disclosed
Send feedback