SCHEMBL4664271

SCHEMBL4664271

CN[C@@H](C)C(=O)Nc1ccc(OC)c(NS(=O)(=O)c2ccc(-c3ccc(C)o3)cc2Cl)c1.COc1ccc(NC(=O)C(C)(C)N)cc1NS(=O)(=O)c1ccc(-c2ccoc2)c(F)c1.COc1ccc(NC(=O)C(C)(C)N)cc1NS(=O)(=O)c1ccc(-c2ccoc2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 8/20 0.41
ALDH1A1 P00352 6/20 0.34
KMT2A Q03164 3/20 0.34
KDM4E B2RXH2 3/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
HPGD P15428 1/20 0.34
METAP2 P50579 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
ACLY P53396 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL14398049 0.83 GHSR (0.56) GHSRALDH1A1KMT2AMAPTLMNA
SCHEMBL13245992 0.83 GHSR (0.56) GHSRALDH1A1KMT2AMAPTLMNA
SCHEMBL13245976 0.83 GHSR (0.56) GHSRALDH1A1KMT2AMAPTLMNA
SCHEMBL4664122 0.82 ALDH1A1 (0.47) GHSRALDH1A1KMT2AKDM4EMAPT
SCHEMBL4664086 0.81 GHSR (0.58) GHSRALDH1A1KMT2AMAPTLMNA
SCHEMBL13245971 0.80 ALDH1A1 (0.45) GHSRALDH1A1KMT2AKDM4EMAPT
SCHEMBL4665907 0.80 GHSR (0.48) GHSRKMT2AMAPTLMNAMEN1
SCHEMBL13245951 0.79 ALDH1A1 (0.46) GHSRALDH1A1KMT2AKDM4EMAPT
SCHEMBL2996213 0.76 GHSR (0.55) GHSRALDH1A1KMT2AMAPTLMNA
SCHEMBL2992486 0.76 GHSR (0.55) GHSRALDH1A1KMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2007716-A1 ARYL AND HETEROARYL SULPHONAMIDES AS GROWTH HORMONE SECRETAGOGUE RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2008-12-31 EP claimed
WO-2007118852-A1 ARYL AND HETEROARYL SULPHONAMIDES AS GROWTH HORMONE SECRETAGOGUE RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2007-10-25 WO claimed