SCHEMBL22503180

SCHEMBL22503180

C=CCCC(=O)NS(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.42
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
NPC1 O15118 1/20 0.35
MAPT P10636 2/20 0.33
ABCC4 O15439 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR4A2 P43354 1/20 0.33
GLS O94925 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
NAMPT P43490 1/20 0.32
FAAH O00519 1/20 0.32
PTGES O14684 1/20 0.31
RBP4 P02753 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
SCHEMBL5662651 0.81 EPHX2 (0.43) EPHX2FNTAFNTBNR4A2MTNR1A
SCHEMBL7737980 0.76 EPHX2 (0.38) EPHX2FNTAFNTBNR4A2MTNR1A
SCHEMBL22503220 0.75 CA1 (0.35) FNTAFNTBALDH1A1LMNANPC1
SCHEMBL442562 0.73
SCHEMBL6015 0.73 HDAC3 (0.50) EPHX2MAPTTSHRNR4A2PTGES
SCHEMBL16353784 0.71 PHF8 (0.48) EPHX2ALDH1A1LMNANR4A2RBP4
SCHEMBL3897925 0.71 EPHX2 (0.38) EPHX2FNTAFNTBALDH1A1LMNA
SCHEMBL1161702 0.71 EPHX2 (0.38) EPHX2FNTAFNTBNR4A2MTNR1A
SCHEMBL397304 0.71 ALDH1A1 (0.42) ALDH1A1LMNAMAPTABCC4FAAH
SCHEMBL8308804 0.70

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-10792489-B2 Bio-electrode composition, bio-electrode, and method for manufacturing the bio-electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-10-06 US disclosed