SCHEMBL4444964

SCHEMBL4444964

Nc1cccc2c(S(=O)(=O)NCc3ccc(Cl)c(Cl)c3)cccc12

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 16/20 0.68
CNR1 P21554 1/20 0.53
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
FPR2 P25090 1/20 0.48
CYP2C19 P33261 1/20 0.48
MTOR P42345 1/20 0.48
CSNK1A1 P48729 1/20 0.48
MYLK Q15746 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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 SCHEMBL4455040 0.99 NSD2 (0.69) NSD2CNR1KDM4ECYP1A2CYP3A4
SCHEMBL10487801 0.87 CNR1 (0.54) NSD2CNR1
SCHEMBL4446610 0.86 NSD2 (0.73) NSD2CNR1
SCHEMBL4454417 0.85 NSD2 (0.78) NSD2CNR1
Hydrochloric Acid SCHEMBL4445435 0.85 NSD2 (0.74) NSD2CNR1
Hydrochloric Acid SCHEMBL4444954 0.84 NSD2 (0.78) NSD2CNR1
SCHEMBL4452473 0.84 NSD2 (0.71) NSD2KDM4ECYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL4446566 0.83 NSD2 (0.71) NSD2KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL4443035 0.83 NSD2 (0.77) NSD2
SCHEMBL4450802 0.82 NSD2 (0.82) NSD2

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