SCHEMBL10420649

SCHEMBL10420649

CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 1/20 0.80
KMT2A Q03164 5/20 0.76
GAA P10253 1/20 0.76
LMNA P02545 4/20 0.76
MEN1 O00255 4/20 0.76
ALDH1A1 P00352 3/20 0.76
SMN1; SMN2 Q16637 3/20 0.76
MAPT P10636 2/20 0.76
TSHR P16473 1/20 0.76
NPSR1 Q6W5P4 1/20 0.76
RECQL P46063 2/20 0.71
HSD17B10 Q99714 2/20 0.71
KDM4E B2RXH2 1/20 0.67
HPGD P15428 5/20 0.67
AR P10275 1/20 0.66
CA2 P00918 2/20 0.65
CA1 P00915 1/20 0.65
ALOX15 P16050 1/20 0.65
MAPK1 P28482 1/20 0.65
CA9 Q16790 1/20 0.64

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
SCHEMBL20981707 0.90 NHERF1 (0.67) NHERF1KMT2AGAALMNAMEN1
SCHEMBL7782225 0.89 NHERF1 (0.76) NHERF1KMT2AGAALMNAMEN1
SCHEMBL5925553 0.87 MAPT (0.72) NHERF1KMT2AGAALMNAMEN1
SCHEMBL13028451 0.87 NHERF1 (0.73) NHERF1KMT2AGAALMNAMEN1
SCHEMBL28280869 0.85 NHERF1 (0.71) NHERF1KMT2AGAALMNAMEN1
SCHEMBL8074273 0.84 MAPT (0.67) NHERF1KMT2AGAALMNAMEN1
SCHEMBL5184903 0.84 KMT2A (0.69) NHERF1KMT2AGAALMNAMEN1
SCHEMBL17331309 0.84 TCF4 (0.79) NHERF1KMT2AGAALMNAMEN1
SCHEMBL16672108 0.82 LMNA (0.63) NHERF1KMT2AGAALMNAMEN1
SCHEMBL23141046 0.82 KMT2A (0.59) NHERF1KMT2AGAALMNAMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4940713-A ANTITUMOR AGENTS BURROUGHS WELLCOME CO. (US) 1990-07-10 US disclosed
EP-0341837-A2 Glutamic acid derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1989-11-15 EP disclosed
US-4211883-A Process for the production of p-(N-methyl)-aminobenzoyl-L-glutamic acid LONZA, LTD. (CH) 1980-07-08 US disclosed