SCHEMBL8367349

SCHEMBL8367349

CCc1cccc(NS(=O)(=O)c2cncn2C)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
TP53 P04637 3/20 0.52
PKM P14618 3/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
MAPK1 P28482 1/20 0.48
PTGS1 P23219 2/20 0.47
PTGS2 P35354 1/20 0.44
POLB P06746 1/20 0.43
AR P10275 1/20 0.43
LMNA P02545 2/20 0.43
ALPL P05186 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA1A P35348 1/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL592360 0.75 PKM (0.52) KMT2ATP53PKMMAPTMEN1
SCHEMBL16205824 0.74 KMT2A (0.41) KMT2ATP53PKMMAPTMEN1
SCHEMBL1690514 0.73 HTR6 (0.72) KMT2ATP53PKMMAPTMEN1
SCHEMBL7902370 0.72 PTGS1 (0.59) KMT2ATP53PKMMAPTMEN1
SCHEMBL8458647 0.72 ADRA2A (0.57) KMT2ATP53PKMMAPTMEN1
SCHEMBL8269562 0.71 TP53 (0.64) KMT2ATP53PKMMAPTMEN1
SCHEMBL24000629 0.70 MAPT (0.55) KMT2ATP53PKMMAPTMEN1
SCHEMBL9616551 0.70 MAPT (0.54) TP53MAPT
SCHEMBL8366960 0.70 MAPT (0.52) KMT2ATP53PKMMAPTMEN1
SCHEMBL8366958 0.70 KIT (0.50) KMT2ATP53PKMMAPTMEN1

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-6512006-B1 Novel 3-position Nitrogen substituted 6,6- disubstituted-5, 6-dihydropyrones and related compounds possess antiviral properties WARNER-LAMBERT COMPANY 2003-01-28 US disclosed