SCHEMBL5793722

SCHEMBL5793722

CCn1c(CNc2ccccc2Cl)nnc1SC(=O)Cc1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ TSHR P16473 5/20 0.54
▸ NPSR1 Q6W5P4 3/20 0.54
▸ MAPT P10636 2/20 0.52
▸ GAA P10253 2/20 0.52
▸ ALDH1A1 P00352 6/20 0.50
▸ LMNA P02545 5/20 0.50
▸ HSP90AA1 P07900 3/20 0.50
▸ HTT P42858 3/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ HPGD P15428 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.44
▸ POLB P06746 1/20 0.41
▸ NPBWR1 P48145 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ MCHR1 Q99705 1/20 0.41

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
SCHEMBL4200066 0.80 MEN1 (0.68) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL5967712 0.78 MEN1 (0.78) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL6061181 0.75 MEN1 (0.64) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL4199207 0.73 TSHR (0.70) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL4206699 0.73 TSHR (0.69) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL6061117 0.72 PTGES (0.58) KMT2ATSHRNPSR1MAPTGAA
SCHEMBL4204241 0.70 TSHR (1.00) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL4207462 0.67 HSP90AA1 (1.00) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL14732156 0.66 SMN1; SMN2 (0.63) MEN1KMT2ATSHRNPSR1MAPT
SCHEMBL4199802 0.65 TSHR (0.75) MEN1KMT2ATSHRMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1615666-A2 COMBINATION OF AN 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITOR AND AN ANTIHYPERTENSIVE AGENT NOVO NORDISK A/S (DK) 2006-01-18 — — EP claimed
WO-2004089416-A2 COMBINATION OF AN 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITOR AND AN ANTIHYPERTENSIVE AGENT NOVO NORDISK A/S (DK) 2004-10-21 — — WO claimed
EP-1615667-A2 COMBINATIONS OF AN 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITOR AND A GLUCOCORTICOID RECEPTOR AGONIST NOVO NORDISK A/S (DK) 2006-01-18 — — EP disclosed
EP-1615637-A1 PHARMACEUTICAL USE OF SUBSTITUTED 1,2,4-TRIAZOLES NOVO NORDISK A/S (DK) 2006-01-18 — — EP disclosed
WO-2004089367-A1 PHARMACEUTICAL USE OF SUBSTITUTED 1,2,4-TRIAZOLES NOVO NORDISK A/S (DK) 2004-10-21 — — WO disclosed
WO-2004089415-A2 COMBINATIONS OF AN 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITOR AND A GLUCOCORTICOID RECEPTOR AGONIST NOVO NORDISK A/S (DK) 2004-10-21 — — WO disclosed
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