SCHEMBL4455037

SCHEMBL4455037

Nc1cccc2c(S(=O)(=O)N3CCc4ccccc4C3)cccc12

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
ESR1 P03372 2/20 0.56
ESR2 Q92731 2/20 0.56
LMNA P02545 2/20 0.55
MAPK1 P28482 2/20 0.55
MEN1 O00255 3/20 0.55
AKR1C3 P42330 4/20 0.49
TSHR P16473 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
AKR1C1 Q04828 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
POLB P06746 1/20 0.46

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 SCHEMBL4452980 0.99 KMT2A (0.59) KMT2AL3MBTL1ESR1ESR2LMNA
SCHEMBL4449287 0.90 TTR (0.51) KMT2AL3MBTL1ESR1ESR2LMNA
Hydrochloric Acid SCHEMBL4448322 0.89 TTR (0.50) KMT2AL3MBTL1ESR1ESR2MAPK1
Hydrochloric Acid SCHEMBL6909934 0.81 SMN1; SMN2 (0.46) KMT2AL3MBTL1ESR1ESR2LMNA
SCHEMBL6968140 0.77 ESR2 (0.74) KMT2AL3MBTL1ESR1ESR2LMNA
SCHEMBL4455025 0.77 KMT2A (0.52) KMT2AL3MBTL1ESR1ESR2LMNA
SCHEMBL7837749 0.77 SMN1; SMN2 (0.77) KMT2ALMNAMAPK1MEN1TSHR
SCHEMBL6448521 0.75 KMT2A (0.63) KMT2AL3MBTL1ESR1ESR2LMNA
SCHEMBL25532 0.75 POLB (0.58) KMT2ALMNAMEN1TSHRSMN1; SMN2
SCHEMBL13788913 0.74 KMT2A (0.63) KMT2AL3MBTL1MEN1SMN1; 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-7547716-B2 Sulfonamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-06-16 US claimed