SCHEMBL4191602

SCHEMBL4191602

CC(C)[Si](OC1CCN([C@@H](c2ccc(-c3ccc(C(=O)O)c(Cl)c3)cc2)C2CCNC2=O)CC1)(C(C)C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.35
AKR1C2 P52895 1/20 0.34
AKR1C1 Q04828 1/20 0.34
PRKAB2 O43741 7/20 0.33
PRKAG1 P54619 7/20 0.33
PRKAA2 P54646 7/20 0.33
PRKAA1 Q13131 7/20 0.33
PRKAG3 Q9UGI9 7/20 0.33
PRKAG2 Q9UGJ0 7/20 0.33
PRKAB1 Q9Y478 7/20 0.33
ADRB1 P08588 3/20 0.32
ADRB3 P13945 3/20 0.32
GCK P35557 1/20 0.31
KMO O15229 3/20 0.31
MAP3K5 Q99683 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
MEN1 O00255 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL1092228 0.85 PDE4A (0.33) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL1094081 0.85 PDE4A (0.33) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL1092157 0.85 PDE4D (0.32) AKR1C2AKR1C1PRKAB2PRKAG1PRKAA2
SCHEMBL209090 0.81 XDH (0.33) XDHAKR1C2AKR1C1PRKAB2PRKAG1
SCHEMBL1093033 0.81 PSD (0.34) HRH3KCNH2
SCHEMBL1092147 0.80 PSD (0.35) HRH3KCNH2
SCHEMBL208541 0.74 SRD5A2 (0.32) AKR1C2AKR1C1PRKAB2PRKAG1PRKAA2
SCHEMBL4060990 0.74 SRD5A2 (0.32) AKR1C2AKR1C1PRKAB2PRKAG1PRKAA2
SCHEMBL4197218 0.73 CHEK2 (0.36) MEN1KMT2A
SCHEMBL1091969 0.72 SCN1A (0.32)

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-2021336-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2009-02-11 EP disclosed
WO-2007127688-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 WO disclosed