SCHEMBL8869733

SCHEMBL8869733

COC(=O)CNC(=O)c1cc(C(=O)NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)ccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 6/20 0.53
ALKBH2 Q6NS38 5/20 0.53
ALKBH3 Q96Q83 5/20 0.53
ALKBH5 Q6P6C2 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
P4HTM Q9NXG6 1/20 0.41
BCL2L1 Q07817 4/20 0.41
MCL1 Q07820 4/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 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
SCHEMBL8867785 0.90 ALKBH2 (0.52) FTOALKBH2ALKBH3ALKBH5SMN1; SMN2
SCHEMBL8869527 0.88 ALKBH2 (0.54) FTOALKBH2ALKBH3ALKBH5SMN1; SMN2
SCHEMBL8870003 0.85 P4HTM (0.56) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL7871560 0.78 MEN1 (0.41) FTOALKBH2ALKBH3ALKBH5SMN1; SMN2
SCHEMBL7867676 0.77 EPHX2 (0.42) FTOALKBH2ALKBH3ALKBH5SMN1; SMN2
SCHEMBL8869937 0.77 P4HTM (0.52) SMN1; SMN2NPC1RAB9AP4HTMBCL2L1
SCHEMBL8869556 0.77 POLB (0.45) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL8868286 0.75 P4HTM (0.55) SMN1; SMN2NPC1RAB9AALDH1A1MEN1
SCHEMBL8868423 0.74 ALKBH2 (0.52) FTOALKBH2ALKBH3ALKBH5ALDH1A1
SCHEMBL8868467 0.74 P4HTM (0.71) MEN1KMT2AP4HTM

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