SCHEMBL8868009

SCHEMBL8868009

CC(=O)NCCc1ccc(S(=O)(=O)NC(=O)c2ccc(C(=O)NCCOC(=O)c3ccccc3C)nc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 3/20 0.46
LMNA P02545 3/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP3A4 P08684 1/20 0.42
HTR1A P08908 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
CNR1 P21554 1/20 0.42
CYP2C19 P33261 1/20 0.42
ADRA1A P35348 1/20 0.42
BLM P54132 1/20 0.42
POLB P06746 2/20 0.41
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
PPARA Q07869 1/20 0.39
USP2 O75604 1/20 0.39
NPC1 O15118 2/20 0.39

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
SCHEMBL8868704 0.94 P4HTM (0.48) P4HTMLMNAMAPTSMN1; SMN2CYP3A4
SCHEMBL8868529 0.92 PPARA (0.49) P4HTMLMNAMAPTSMN1; SMN2CYP3A4
SCHEMBL8870501 0.91 P4HTM (0.43) P4HTMLMNAMAPTSMN1; SMN2CYP3A4
SCHEMBL8868612 0.91 P4HTM (0.45) P4HTMLMNAMAPTSMN1; SMN2CYP3A4
SCHEMBL7870557 0.89 POLB (0.40) P4HTMLMNAMAPTSMN1; SMN2POLB
SCHEMBL8868547 0.87 P4HTM (0.47) P4HTMLMNAMAPTSMN1; SMN2CYP3A4
SCHEMBL8867585 0.87 NLRP3 (0.57) LMNAMAPTCYP3A4CYP2C9TSHR
SCHEMBL8870423 0.87 LMNA (0.48) P4HTMLMNAMAPTSMN1; SMN2PPARA
SCHEMBL8869375 0.85 P4HTM (0.51) P4HTMLMNAMAPTSMN1; SMN2CYP3A4
SCHEMBL7874575 0.83 MAPT (0.43) P4HTMLMNAMAPTSMN1; SMN2POLB

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