SCHEMBL8446359

SCHEMBL8446359

CS(=O)(=O)c1cc(C(=O)NC(=N)N)ccc1Oc1ccc(C(=O)CSc2nc3ccccc3[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA7 P43166 2/20 0.51
CA13 Q8N1Q1 2/20 0.51
GCGR P47871 4/20 0.49
MAPT P10636 7/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALPL P05186 2/20 0.47
ALPG P10696 2/20 0.47
ALDH1A1 P00352 4/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ALOX15 P16050 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HCRTR1 O43613 1/20 0.42
POLB P06746 2/20 0.41

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 SCHEMBL8444771 0.99 CA1 (0.51) CA1CA2CA7CA13GCGR
Hydrochloric Acid SCHEMBL8070136 0.87 MAPT (0.40) CA1CA2CA7CA13GCGR
SCHEMBL8446364 0.87 CA1 (0.55) CA1CA2CA7CA13GCGR
SCHEMBL8446986 0.84 CTSZ (0.40) CA1CA2CA7CA13MAPT
Hydrochloric Acid SCHEMBL8521359 0.83 CTSZ (0.40) CA1CA2CA7CA13MAPT
SCHEMBL8446360 0.83 TSHR (0.45) MAPTMEN1KMT2AALDH1A1NPC1
Hydrochloric Acid SCHEMBL8068543 0.82 TSHR (0.45) MAPTMEN1KMT2AALDH1A1NPC1
Hydrochloric Acid SCHEMBL8446098 0.81 RAB9A (0.45) MAPTKMT2AALDH1A1NPC1RAB9A
Hydrochloric Acid SCHEMBL8444221 0.78 CYP3A4 (0.44) MAPTALDH1A1SMN1; SMN2GAAHTT
SCHEMBL8499411 0.77 GCK (0.42) GAA

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