SCHEMBL8551429

SCHEMBL8551429

O=C(Nc1ccnn1-c1ccccc1)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 9/20 0.56
OXTR P30559 3/20 0.54
CYP2C19 P33261 4/20 0.53
CYP2C18 P33260 2/20 0.53
CYP3A4 P08684 2/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.53
TSHR P16473 1/20 0.53
NFKB1 P19838 1/20 0.53
THPO P40225 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
KMT2A Q03164 2/20 0.53
AVPR1A P37288 2/20 0.50
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP2C8 P10632 2/20 0.47

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
SCHEMBL8553556 0.88 CYP2C9 (0.70) CYP2C9CYP2C19CYP2C18CYP3A4LMNA
SCHEMBL8550596 0.81 NTRK1 (0.65) LMNAPOLBTSHRNPSR1KMT2A
SCHEMBL8555136 0.79 CYP2C9 (0.50) CYP2C9CYP2C19CYP2C18CYP3A4LMNA
SCHEMBL23747737 0.76 NAMPT (0.61) CYP2C9OXTRCYP2C19CYP2C18CYP3A4
SCHEMBL8552452 0.76 PTGS1 (0.62) CYP2C9CYP2C19CYP3A4KMT2AFLT1
SCHEMBL5186566 0.75 LMNA (0.72) CYP2C9CYP2C19CYP3A4LMNATSHR
SCHEMBL19732074 0.74 TSHR (0.59) CYP2C9TSHRKMT2AMAPK13MAPK12
SCHEMBL3433504 0.73 CYP2C9 (0.55) CYP2C9CYP2C19CYP2C18CYP3A4LMNA
SCHEMBL9529388 0.72 LMNA (0.63) CYP2C9LMNAKMT2AFLT1FLT4
SCHEMBL1984012 0.72 NTRK1 (0.48) LMNAPOLBFLT1FLT4KDR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP claimed
EP-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed