SCHEMBL11530342

SCHEMBL11530342

C=CS(=O)(=O)CCC(=O)NCCN(CCNC(=O)CCS(=O)(=O)C=C)C(=O)CCS(=O)(=O)C=C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
DNM1 Q05193 1/20 0.31
ALDH1A1 P00352 1/20 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
SCHEMBL11591201 0.81 L3MBTL1 (0.42) L3MBTL1TSHRSMN1; SMN2MAPTALDH1A1
SCHEMBL2816085 0.76 TSHR (0.38) L3MBTL1TSHRSMN1; SMN2MAPTALDH1A1
SCHEMBL11133899 0.76 TSHR (0.41) L3MBTL1TSHRSMN1; SMN2MAPTALDH1A1
SCHEMBL11528810 0.75 L3MBTL1 (0.36) L3MBTL1DNM1
SCHEMBL11045104 0.73 LMNA (0.41) ALDH1A1
SCHEMBL14268182 0.73 ALDH1A1 (0.43) L3MBTL1TSHRSMN1; SMN2MAPTALDH1A1
SCHEMBL11048256 0.72 TSHR (0.31) TSHRSMN1; SMN2MAPT
SCHEMBL11594090 0.71 L3MBTL1 (0.32) L3MBTL1
SCHEMBL10537690 0.69 TSHR (0.55) TSHRSMN1; SMN2MAPTALDH1A1
SCHEMBL11596131 0.69 FAAH (0.36) L3MBTL1TSHRSMN1; SMN2MAPTALDH1A1

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-4134770-A VINYLSULFONYLPROPIONYL COMPOUNDS MITSUBISHI PAPER MILLS, LTD. (JP) 1979-01-16 US disclosed