SCHEMBL8869285

SCHEMBL8869285

O=C(Cc1ccccc1)NCCc1ccc(S(=O)(=O)NC(=O)c2ccc(C(=O)NCC(=O)OCc3ccccc3)nc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 5/20 0.47
CA2 P00918 3/20 0.46
CA1 P00915 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
BCL2L1 Q07817 5/20 0.43
MCL1 Q07820 5/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL8868297 0.93 P4HTM (0.47) P4HTMCA2BCL2L1MCL1NPC1
SCHEMBL8867950 0.92 P4HTM (0.48) P4HTMCA2BCL2L1MCL1NPC1
SCHEMBL8868789 0.92 P4HTM (0.48) P4HTMCA2CA1CA5ACA7
SCHEMBL8869506 0.91 P4HTM (0.50) P4HTMCA2BCL2L1MCL1NPC1
SCHEMBL8868373 0.91 P4HTM (0.45) P4HTMCA2CA1CA5ACA7
SCHEMBL8868703 0.91 POLB (0.49) P4HTMBCL2L1MCL1MEN1KMT2A
SCHEMBL8868801 0.91 CA2 (0.46) P4HTMCA2BCL2L1MCL1NPC1
SCHEMBL8868802 0.91 P4HTM (0.48) P4HTMCA2BCL2L1MCL1NPC1
SCHEMBL8869143 0.90 P4HTM (0.52) P4HTMCA2CA1CA5ACA7
SCHEMBL8869589 0.89 MAPT (0.54) P4HTMCA2BCL2L1MCL1NPC1

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