SCHEMBL8867656

SCHEMBL8867656

O=C(NCCc1ccc(S(=O)(=O)NC(=O)c2ccc(C(=O)NCCO)nc2)cc1)c1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
CA12 O43570 2/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA9 Q16790 2/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
P4HTM Q9NXG6 1/20 0.47
PTGS2 P35354 4/20 0.47
HTT P42858 1/20 0.47
BCL2L1 Q07817 1/20 0.47
MCL1 Q07820 1/20 0.47
PTGS1 P23219 2/20 0.46
LMNA P02545 2/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.45
HTR1A P08908 1/20 0.45

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
SCHEMBL8869154 1.00 MAPT (0.54) MAPTCA12CA1CA2CA9
SCHEMBL8867801 0.91 MAPT (0.52) MAPTCA12CA1CA2CA9
SCHEMBL9139633 0.91 P4HTM (0.60) MAPTCA12CA1CA2CA9
SCHEMBL9140540 0.91 P4HTM (0.60) MAPTCA12CA1CA2CA9
SCHEMBL8867818 0.91 P4HTM (0.57) MAPTCA12CA1CA2CA9
SCHEMBL8868351 0.91 EGFR (0.57) MAPTCA12CA1CA2CA9
SCHEMBL8869334 0.91 EGFR (0.57) MAPTCA12CA1CA2CA9
SCHEMBL8869630 0.91 MAPT (0.53) MAPTCA12CA1CA2CA9
SCHEMBL8868306 0.91 MAPT (0.53) MAPTCA12CA1CA2CA9
SCHEMBL8869159 0.90 P4HTM (0.58) MAPTNPC1RAB9ASMN1; SMN2MEN1

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
US-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed