SCHEMBL4736691

SCHEMBL4736691

CC(C)(C)OC(=O)CCC1(C(=O)O)SC(Nc2ccccc2C(F)(F)F)=NC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.39
LMNA P02545 1/20 0.39
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
ITGB1 P05556 1/20 0.36
ITGA4 P13612 1/20 0.36
GAA P10253 4/20 0.34
KMT2A Q03164 5/20 0.34
RAB9A P51151 2/20 0.34
P2RX7 Q99572 1/20 0.33
MEN1 O00255 3/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL1605425 0.89 POLB (0.37) POLBLMNAGAAKMT2ARAB9A
SCHEMBL1605368 0.81 EPHX2 (0.41) POLBGAAKMT2ARAB9AMEN1
SCHEMBL1690489 0.79 AKR1C3 (0.34) POLBLMNAAKR1C3AKR1C2GAA
SCHEMBL1604713 0.76 POLB (0.41) POLBLMNAAKR1C3AKR1C2ITGB1
SCHEMBL1690484 0.71 POLB (0.33) POLBLMNAGAAKMT2ARAB9A
SCHEMBL1606239 0.69 KMT2A (0.42) POLBLMNAAKR1C3AKR1C2GAA
SCHEMBL1606321 0.67 HSD11B1 (0.46) POLBAKR1C3AKR1C2GAAKMT2A
SCHEMBL1605509 0.65 KMT2A (0.40) POLBAKR1C3AKR1C2GAAKMT2A
SCHEMBL14531551 0.65 KMT2A (0.36) AKR1C3AKR1C2GAAKMT2ARAB9A
SCHEMBL1605354 0.64 POLB (0.40) POLBAKR1C3AKR1C2GAAKMT2A

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 5 patents. 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
EP-1951696-A2 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 Amgen Inc. (US) 2008-08-06 EP disclosed
WO-2007061661-A2 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC. (US) 2007-05-31 WO disclosed
EP-1753736-A2 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 Amgen Inc. (US) 2007-02-21 EP disclosed
WO-2005116002-A2 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC. (US) 2005-12-08 WO disclosed