SCHEMBL5623747

SCHEMBL5623747

CC(NC(=O)c1ccc(Br)c(S(=O)(=O)N2CCCC2)c1)C(C)(C)C

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.67
CNR1 P21554 4/20 0.67
MAPT P10636 4/20 0.60
KMT2A Q03164 3/20 0.60
LMNA P02545 2/20 0.60
TP53 P04637 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
MAPK1 P28482 2/20 0.59
TSHR P16473 2/20 0.58
RAB9A P51151 2/20 0.58
GAA P10253 2/20 0.57
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 1/20 0.55
GLA P06280 1/20 0.55
MEN1 O00255 1/20 0.55

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
SCHEMBL5623387 0.90 CNR2 (0.78) CNR2CNR1MAPTKMT2ALMNA
SCHEMBL3946686 0.85 CNR2 (0.62) CNR2CNR1MAPTLMNATP53
SCHEMBL5623628 0.80 CNR2 (1.00) CNR2CNR1MAPTKMT2ALMNA
SCHEMBL14367344 0.80 CNR2 (0.78) CNR2CNR1MAPTKMT2ALMNA
SCHEMBL5918077 0.79 CNR2 (0.48) CNR2CNR1MAPTKMT2ALMNA
SCHEMBL5624876 0.79 CNR2 (0.48) CNR2CNR1KMT2ALMNASMN1; SMN2
SCHEMBL5623378 0.79 CNR2 (1.00) CNR2CNR1MAPTKMT2ALMNA
SCHEMBL5624009 0.77 CNR2 (1.00) CNR2CNR1MAPTKMT2ALMNA
SCHEMBL5623047 0.76 MAPK1 (0.77) CNR2CNR1MAPTKMT2ALMNA
SCHEMBL11185044 0.76 MAPK1 (0.77) CNR2CNR1MAPTKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7297796-B2 Sulfamoyl benzamide derivatives and methods of their use ADOLOR CORPORATION (US) 2007-11-20 US claimed
US-7297796-B2 Sulfamoyl benzamide derivatives and methods of their use ADOLOR CORPORATION (US) 2007-11-20 US disclosed
US-7297796-B2 Sulfamoyl benzamide derivatives and methods of their use ADOLOR CORPORATION (US) 2007-11-20 US disclosed
US-7297796-B2 Sulfamoyl benzamide derivatives and methods of their use ADOLOR CORPORATION (US) 2007-11-20 US disclosed