SCHEMBL4540367

SCHEMBL4540367

CC(C)(c1cccc(O)c1)c1nnc2n1CCCCCC2

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.50
HPGD P15428 8/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 3/20 0.42
POLB P06746 2/20 0.41
HTT P42858 1/20 0.40
HSD11B2 P80365 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL4539384 0.85 HPGD (0.54) HSD11B1HPGDALDH1A1POLBHTT
SCHEMBL4538193 0.78 HPGD (0.55) HSD11B1HPGDALDH1A1POLBHTT
SCHEMBL4534788 0.76 HPGD (0.57) HSD11B1HPGDKDM4EPOLBHTT
SCHEMBL4540694 0.74 HPGD (0.57) HSD11B1HPGDALDH1A1POLBHTT
SCHEMBL4536746 0.73 POLB (0.50) HSD11B1HPGDALDH1A1POLBHTT
SCHEMBL4530537 0.72 HPGD (0.41) HSD11B1HPGDALDH1A1POLBHTT
SCHEMBL14030375 0.71 POLB (0.58) HSD11B1HPGDKDM4EALDH1A1POLB
SCHEMBL14030255 0.71 POLB (0.58) HSD11B1HPGDKDM4EALDH1A1POLB
SCHEMBL4536685 0.71 POLB (0.51) HSD11B1HPGDALDH1A1POLBHTT
SCHEMBL4539612 0.71 POLB (0.48) HSD11B1HPGDALDH1A1POLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009073460-A2 INHIBITION OF 11 BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 FOR OCULAR NEUROPROTECTION BAUSCH & LOMB INCORPORATED (US) 2009-06-11 WO disclosed
US-7179802-B2 11-beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2007-02-20 US disclosed
US-7179802-B2 11-beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2007-02-20 US disclosed
US-7179802-B2 11-beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia MERCK & CO., INC. (US) 2007-02-20 US disclosed