SCHEMBL2827378

SCHEMBL2827378

CC(C)(Oc1ccc(Cl)cc1)/C(=N/C#N)NC1C2CC3CC1CC(/C(N)=N/O)(C3)C2

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.74
HSD11B2 P80365 15/20 0.74

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
SCHEMBL2827380 1.00 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL2823236 0.90 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL2825105 0.90 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL2823232 0.90 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL2828330 0.87 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL2822879 0.87 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL2822877 0.87 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL2831285 0.86 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL2835289 0.85 HSD11B1 (0.55) HSD11B1HSD11B2
SCHEMBL2835293 0.85 HSD11B1 (0.55) HSD11B1HSD11B2

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-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP claimed
EP-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP disclosed