SCHEMBL4449287

SCHEMBL4449287

Nc1cccc2c(S(=O)(=O)N3Cc4ccccc4C3)cccc12

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
KMT2A Q03164 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NSD2 O96028 8/20 0.45
MEN1 O00255 1/20 0.45
ATM Q13315 1/20 0.44
POLB P06746 1/20 0.42
MAPK1 P28482 1/20 0.42
LMNA P02545 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
Hydrochloric Acid SCHEMBL4448322 0.98 TTR (0.50) TTRSMN1; SMN2ESR1ESR2KMT2A
SCHEMBL4455037 0.90 KMT2A (0.60) SMN1; SMN2ESR1ESR2KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL4452980 0.89 KMT2A (0.59) SMN1; SMN2ESR1ESR2KMT2AL3MBTL1
SCHEMBL7837749 0.79 SMN1; SMN2 (0.77) TTRSMN1; SMN2KMT2AMEN1ATM
SCHEMBL13788913 0.77 KMT2A (0.63) TTRSMN1; SMN2KMT2AL3MBTL1NSD2
SCHEMBL25532 0.77 POLB (0.58) TTRSMN1; SMN2KMT2AMEN1ATM
Hydrochloric Acid SCHEMBL6911530 0.76 ESR1 (0.50) SMN1; SMN2ESR1ESR2KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL6909934 0.76 SMN1; SMN2 (0.46) TTRSMN1; SMN2ESR1ESR2KMT2A
SCHEMBL4445137 0.74 EDNRA (0.48) SMN1; SMN2ESR1ESR2KMT2AMEN1
SCHEMBL7104945 0.71 CYP3A4 (0.57) SMN1; SMN2KMT2AMEN1POLBMAPK1

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-7547716-B2 Sulfonamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-06-16 US claimed