SCHEMBL7316902

SCHEMBL7316902

Cc1cc(C)c(S(=O)(=O)c2nc[nH]n2)c(C)c1.Cc1cc(C)c(S(=O)(=O)c2ncn(C(=O)N(C)c3ccccc3)n2)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ACHE P22303 1/20 0.32
LIPE Q05469 1/20 0.32
GAA P10253 1/20 0.31
KDM4E B2RXH2 2/20 0.31
POLB P06746 1/20 0.31
NR4A1 P22736 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
POLQ O75417 1/20 0.31
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RECQL P46063 1/20 0.30
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
TP53 P04637 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
SCHEMBL5381321 0.91 ALDH1A1 (0.42) ALDH1A1MAPTNPSR1SMN1; SMN2MEN1
SCHEMBL5376972 0.77 ALDH1A1 (0.45) ALDH1A1MAPTNPSR1KMT2AKDM4E
SCHEMBL5385244 0.75 DPP4 (0.48) ALDH1A1MAPTNPSR1KMT2AKDM4E
SCHEMBL5371744 0.74 RAPGEF4 (0.44) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL5381790 0.74 ALDH1A1 (0.40) ALDH1A1MAPTNPSR1MEN1KMT2A
Cafenstrole SCHEMBL54625 0.73 KMT2A (0.49) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL5378985 0.71 ALDH1A1 (0.38) ALDH1A1MAPTNPSR1MEN1KMT2A
SCHEMBL8859187 0.70 F2 (0.40) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL9378261 0.66 DPP4 (0.36) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
Cafenstrole SCHEMBL14655384 0.65 KDM4E (0.36) ALDH1A1KMT2AKDM4E

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
EP-1258480-A1 Pharmaceutical use of N-Carbamoylazole derivatives Eisai Co., Ltd. (JP) 2002-11-20 EP disclosed