SCHEMBL474722

SCHEMBL474722

O=C1CCCN1[C@H]1CC[C@@H](F)CC1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 5/20 0.40
BRD4 O60885 1/20 0.35
BRD2 P25440 1/20 0.35
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
MGLL Q99685 1/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
CYP2D6 P10635 1/20 0.34
HRH1 P35367 1/20 0.34
MMP13 P45452 1/20 0.34
KDM5A P29375 1/20 0.33
CD38 P28907 1/20 0.33
LTA4H P09960 1/20 0.32
KCNH2 Q12809 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
SCHEMBL474850 1.00 NPY5R (0.40) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL474721 1.00 NPY5R (0.40) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL17185334 0.89
SCHEMBL11842283 0.83 NOS3 (0.45) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL2176405 0.83 DPP4 (0.43) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL6335314 0.83 NOS3 (0.45) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL23917218 0.81 NOS3 (0.43) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL20858617 0.81 NOS3 (0.43) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL22889 0.81 NOS3 (0.43) NPY5RBRD4BRD2NOS3NOS1
SCHEMBL22859782 0.80 NPY5R (0.38) NPY5RBRD4BRD2NOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049475-B1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2012-02-01 EP disclosed
US-7998999-B2 Cyclohexyl substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2011-08-16 US disclosed
CN-101432262-B Cyclohexyl-substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 LILLY CO ELI 2011-06-01 CN disclosed
US-20090239911-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-09-24 US disclosed
CN-101432262-A Cyclohexyl-substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 LILLY CO ELI (US) 2009-05-13 CN disclosed
EP-2049475-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 Eli Lilly & Company (US) 2009-04-22 EP disclosed
WO-2007127704-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090239911-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 NPY5R 706/4885BRD4 2484/4885BRD2 2920/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.