SCHEMBL9614152

SCHEMBL9614152

Cc1ccc(S(=O)(=O)O)c(C(C)C)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.35
FABP3 P05413 1/20 0.34
FABP4 P15090 1/20 0.34
FABP5 Q01469 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
PTGS1 P23219 2/20 0.32
TRPA1 O75762 1/20 0.32
CACNA1C Q13936 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TRPV4 Q9HBA0 1/20 0.32
MYC P01106 1/20 0.32
POLB P06746 2/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
PMP22 Q01453 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL4617196 0.79 MEN1 (0.38) IDH1KMT2AMEN1ALDH1A1MYC
SCHEMBL9232836 0.78 MEN1 (0.39) KMT2AMEN1ALDH1A1MYCPOLB
SCHEMBL9828277 0.77 MEN1 (0.44) IDH1KMT2AMEN1PTGS1ALDH1A1
SCHEMBL9248364 0.74 MEN1 (0.36) IDH1KMT2AMEN1ALDH1A1MYC
SCHEMBL19025061 0.74 MYC (0.41) FABP3FABP4FABP5KMT2AMEN1
SCHEMBL12967883 0.74 LMNA (0.34) PTGS1TRPA1CACNA1CLMNA
SCHEMBL719443 0.72 FABP3 (0.41) FABP3FABP4FABP5PTGS1TRPA1
Hydrochloric Acid SCHEMBL27291943 0.71 CYP1A2 (0.38) KMT2AMEN1ALDH1A1MYCLMNA
SCHEMBL26769520 0.71 TRPA1 (0.42) KMT2APTGS1TRPA1CACNA1CALDH1A1
SCHEMBL9232844 0.70 MEN1 (0.39) KMT2AMEN1ALDH1A1MYCPOLB

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-5155272-A Process for the production of haloacylamides MONSANTO COMPANY (US) 1992-10-13 US disclosed