SCHEMBL7829614

SCHEMBL7829614

Nc1ccc(S(=O)(=O)Nc2cc(Br)cc3c2N=CC3Cl)cn1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.40
PIK3CG P48736 5/20 0.39
HTR6 P50406 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GCK P35557 1/20 0.35
GCKR Q14397 1/20 0.35
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
METAP2 P50579 1/20 0.32
KDM1A O60341 2/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32

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
SCHEMBL2767577 0.70 CA1 (0.48) PIK3CDPIK3CGHTR6KDM4EGAA
SCHEMBL2767866 0.61 CA1 (0.44) PIK3CDPIK3CGKDM4EGAAMEN1
SCHEMBL6049162 0.61 CA1 (0.46) PIK3CDPIK3CGKDM4ELMNAGAA
SCHEMBL28512160 0.61 SMN1; SMN2 (0.68) KDM4ELMNAGAAMEN1KMT2A
SCHEMBL3064412 0.60 PIK3CG (0.46) PIK3CGHTR6KDM4ELMNAMEN1
SCHEMBL17337 0.60 KDM4E (0.56) HTR6KDM4EGCKGCKRLMNA
SCHEMBL17298731 0.59 ALDH1A1 (0.57) KDM4EGCKRMEN1KMT2AKDM1A
SCHEMBL1389216 0.59 CA12 (0.46) PIK3CDPIK3CGHTR6KDM4EGAA
SCHEMBL19332648 0.59 KDM4E (0.47) PIK3CDPIK3CGKDM4ELMNA
SCHEMBL259517 0.59 MAPK1 (0.54) PIK3CDPIK3CGHTR6LMNAGAA

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-1074542-A1 SULFONAMIDE-CONTAINING INDOLE COMPOUNDS Eisai Co., Ltd. (JP) 2001-02-07 EP disclosed