SCHEMBL8446233

SCHEMBL8446233

CS(=O)(=O)c1cc(C(=O)NC(=N)N)ccc1Oc1ccc(S(=O)(=O)NCCc2c[nH]cn2)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MRGPRX1 Q96LB2 2/20 0.34
F2 P00734 3/20 0.34
PLG P00747 1/20 0.34
F10 P00742 4/20 0.34
PRSS1 P07477 3/20 0.34
PRSS2 P07478 3/20 0.34
PRSS3 P35030 3/20 0.34
ALDH1A1 P00352 3/20 0.33
RECQL P46063 1/20 0.33
HTT P42858 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
Hydrochloric Acid SCHEMBL8068552 0.99 MAPT (0.35) MAPTKDM4EMRGPRX1F2PLG
SCHEMBL8070556 0.88 MAPT (0.47) MAPTKDM4EHTTTSHR
SCHEMBL8446235 0.87 SLC9A1 (0.40) MAPTKDM4E
Hydrochloric Acid SCHEMBL8070501 0.86 SLC9A1 (0.39) MAPTKDM4E
Hydrochloric Acid SCHEMBL8445991 0.86 KDM4E (0.51) MAPTKDM4EF2F10PRSS1
SCHEMBL8446232 0.82 MRGPRX1 (0.35) MRGPRX1F10ALDH1A1LMNA
Hydrochloric Acid SCHEMBL8068549 0.81 MRGPRX1 (0.34) MRGPRX1F10ALDH1A1LMNA
SCHEMBL8444243 0.80 ALDH1A1 (0.53) ALDH1A1LMNATSHRSMN1; SMN2
SCHEMBL8444776 0.80 SIGMAR1 (0.46) ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL8070683 0.79 ALDH1A1 (0.52) ALDH1A1LMNATSHRSMN1; SMN2

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-0723956-B1 Basically substituted benzoylguanidines, process for their preparation, their use as medicaments or diagnostics as well as medicaments containing them HOECHST AG (DE) 1999-10-13 EP claimed