SCHEMBL14532014

SCHEMBL14532014

C[C@@]1(C(F)(F)F)SC(NCC2C[C@@H]3CCC2C3)=NC1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD11B1 P28845 1/20 0.32
BTK Q06187 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
SCHEMBL14344693 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL10249079 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL5023741 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL5023744 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL5023746 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL14531582 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL10249197 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL14344641 1.00 MEN1 (0.33) MEN1KMT2AHSD11B1BTK
SCHEMBL10249084 0.80 HSD11B1 (0.40) MEN1KMT2AHSD11B1
SCHEMBL14531578 0.80 HSD11B1 (0.40) MEN1KMT2AHSD11B1

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
WO-2007061661-A2 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC. (US) 2007-05-31 WO disclosed