SCHEMBL5015319

SCHEMBL5015319

CCC1(C)SC(N(C)C2CCCCC2)=NC1=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.43
GAA P10253 1/20 0.33
JAK3 P52333 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL5016462 0.90 HSD11B1 (0.44) HSD11B1GAAJAK3
SCHEMBL1605164 0.86 HSD11B1 (0.34) HSD11B1GAA
SCHEMBL1605602 0.85 HSD11B1 (0.33) HSD11B1MEN1KMT2A
SCHEMBL5065069 0.73 HSD11B1 (0.40) HSD11B1KMT2A
SCHEMBL5016864 0.73 HSD11B1 (0.40) HSD11B1KMT2A
SCHEMBL5016418 0.73 HSD11B1 (0.40) HSD11B1KMT2A
SCHEMBL1605628 0.73 HSD11B1 (0.40) HSD11B1KMT2A
SCHEMBL5630610 0.73 HSD11B1 (0.40) HSD11B1KMT2A
SCHEMBL1605493 0.73 MEN1 (0.33) GAAJAK3MEN1KMT2A
SCHEMBL1605435 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753736-B1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC (US) 2008-12-17 EP disclosed