SCHEMBL6424261

SCHEMBL6424261

NN(C(=O)C1CC1)c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
PTGIR P43119 2/20 0.38
PTGDR Q13258 2/20 0.38
KMT2A Q03164 2/20 0.37
CYP46A1 Q9Y6A2 1/20 0.36
NOTUM Q6P988 1/20 0.36
HSD11B1 P28845 1/20 0.36
MLNR O43193 1/20 0.36
TSHR P16473 1/20 0.35
TP53 P04637 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34

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
SCHEMBL6423500 0.93 L3MBTL1 (0.38) PTGIRPTGDRHSD11B1TSHRNPC1
SCHEMBL6420648 0.81 HTT (0.43) HTTPTGIRPTGDRKMT2ANOTUM
SCHEMBL6429633 0.81 HTT (0.59) HTTKMT2ATSHRNPC1RAB9A
SCHEMBL19527535 0.78 APP (0.32) PTGIRPTGDRKMT2ATP53DDB1
SCHEMBL3978591 0.77 NPC1 (0.49) PTGIRPTGDRKMT2ATP53CES2
SCHEMBL742645 0.77 RAB9A (0.42) KMT2ARAB9AMEN1
SCHEMBL6422688 0.75 CNR2 (0.47) HTTKMT2ARAB9A
SCHEMBL19265536 0.75 CNR2 (0.50) KMT2ATP53NPC1RAB9AMEN1
SCHEMBL2259800 0.74 HTT (0.51) HTTKMT2ANPC1RAB9AMEN1
SCHEMBL20268246 0.74 HTT (0.51) HTTKMT2ANPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1532122-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES, OBESITY AND DYSLIPIDEMIA Merck & Co., Inc. (US) 2005-05-25 EP disclosed
WO-2003104208-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES, OBESITY AND DYSLIPIDEMIA MERCK & CO., INC. (US) 2003-12-18 WO disclosed
WO-2003104207-A2 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 INHIBITORS USEFUL FOR THE TREATMENT OF DIABETES, OBESITY AND DYSLIPIDEMIA MERCK & CO., INC. (US) 2003-12-18 WO disclosed