SCHEMBL11595202

SCHEMBL11595202

C=CS(=O)(=O)CCCNC(=O)CCS(=O)(=O)CCCl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.36
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP3A4 P08684 2/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 2/20 0.32
TSHR P16473 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CASP2 P42575 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
SCHEMBL11596131 0.94 FAAH (0.36) FAAHCYP2C19SMN1; SMN2ALDH1A1CYP3A4
SCHEMBL11591201 0.79 L3MBTL1 (0.42) FAAHCYP2C19SMN1; SMN2ALDH1A1KMT2A
SCHEMBL9768557 0.79 ALDH1A1 (0.37) FAAHCYP2C19SMN1; SMN2ALDH1A1KMT2A
SCHEMBL11591963 0.77 KMT2A (0.33) FAAHKMT2APOLBMEN1HTT
SCHEMBL11595057 0.74 KMT2A (0.32) KMT2APOLBMEN1HTTRXFP1
SCHEMBL5383751 0.73 TSHR (0.50) SMN1; SMN2ALDH1A1KMT2AMAPTTSHR
SCHEMBL14593602 0.71 FAAH (0.42) FAAHCYP2C19ALDH1A1KMT2APOLB
SCHEMBL11133899 0.70 TSHR (0.41) SMN1; SMN2ALDH1A1KMT2APOLBMAPT
SCHEMBL11117555 0.70 APEX1 (0.39) KMT2APOLBMEN1HTTRXFP1
SCHEMBL2816085 0.70 TSHR (0.38) FAAHSMN1; SMN2ALDH1A1MAPTTSHR

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-4120898-A Sulfur containing vinyl amide cross-linking agents CIBA-GEIGY AG (CH) 1978-10-17 US disclosed