SCHEMBL5623027

SCHEMBL5623027

O=C(NCc1ccccc1)c1ccc(Br)c(S(=O)(=O)N2CCCC2)c1

nearest known ligand 0.98

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.98
CNR1 P21554 5/20 0.98
SMN1; SMN2 Q16637 2/20 0.69
TSHR P16473 1/20 0.69
MAPT P10636 2/20 0.69
TP53 P04637 1/20 0.69
ALDH1A1 P00352 2/20 0.67
L3MBTL1 Q9Y468 1/20 0.62
RAB9A P51151 1/20 0.61
KDM4E B2RXH2 1/20 0.60
GLA P06280 1/20 0.60
GAA P10253 1/20 0.60
KMT2A Q03164 3/20 0.59
LMNA P02545 2/20 0.59

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
SCHEMBL5624470 0.99 CNR2 (1.00) CNR2CNR1SMN1; SMN2TSHRMAPT
SCHEMBL5623492 0.90 CNR2 (1.00) CNR2CNR1SMN1; SMN2TSHRMAPT
SCHEMBL14485527 0.86 CNR1 (0.78) CNR2CNR1SMN1; SMN2TP53ALDH1A1
SCHEMBL14485159 0.86 CNR1 (0.78) CNR2CNR1SMN1; SMN2TP53ALDH1A1
SCHEMBL5626848 0.86 CNR2 (0.98) CNR2CNR1SMN1; SMN2TSHRTP53
SCHEMBL5625757 0.85 CNR2 (1.00) CNR2CNR1SMN1; SMN2TSHRTP53
SCHEMBL14367344 0.83 CNR2 (0.78) CNR2CNR1SMN1; SMN2TSHRMAPT
SCHEMBL5623628 0.81 CNR2 (1.00) CNR2CNR1SMN1; SMN2TSHRMAPT
SCHEMBL5623378 0.81 CNR2 (1.00) CNR2CNR1SMN1; SMN2TSHRMAPT
SCHEMBL1003299 0.79 MAPK1 (0.79) CNR2CNR1SMN1; SMN2ALDH1A1L3MBTL1

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 8 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
WO-2006044645-A2 SULFAMOYL BENZAMIDES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2006-04-27 WO claimed
US-20060079557-A1 Sulfamoyl benzamide derivatives and methods of their use ADOLOR CORPORATION (US) 2006-04-13 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
WO-2006044645-A2 SULFAMOYL BENZAMIDES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2006-04-27 WO disclosed
US-20060079557-A1 Sulfamoyl benzamide derivatives and methods of their use ADOLOR CORPORATION (US) 2006-04-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060079557-A1 Sulfamoyl benzamide derivatives and methods of their use CNR2, TRPV1, CNR1 CNR2 1/4885CNR1 3/4885SMN1; SMN2 583/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.