SCHEMBL945292

SCHEMBL945292

CC(C)NC(=O)N1CCC(CCOc2ccc(C(=O)N(C)C3C4CC5CC3CC(O)(C5)C4)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.47
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
HSD11B1 P28845 1/20 0.39
TEAD1 P28347 1/20 0.38
TEAD3 Q99594 1/20 0.38
MCHR1 Q99705 1/20 0.37
CHRM2 P08172 1/20 0.37
HRH3 Q9Y5N1 4/20 0.36
IDH1 O75874 1/20 0.35

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
SCHEMBL238436 0.92 GPR119 (0.44) GPR119HRH2HRH1HSD11B1MCHR1
SCHEMBL14097603 0.90 GPR119 (0.43) GPR119HRH2HRH1TEAD1TEAD3
SCHEMBL3632575 0.88 GPR119 (0.47) GPR119HSD11B1TEAD1TEAD3MCHR1
SCHEMBL945293 0.88 GPR119 (0.43) GPR119HRH2HRH1HSD11B1TEAD1
SCHEMBL942710 0.87 GPR119 (0.47) GPR119HRH2HRH1HSD11B1TEAD1
SCHEMBL946687 0.87 IDH1 (0.45) GPR119HSD11B1HRH3IDH1
SCHEMBL945291 0.85 EPHX2 (0.39) GPR119HRH2HRH1TEAD1TEAD3
SCHEMBL946689 0.84 GPR119 (0.45) GPR119HSD11B1TEAD1TEAD3MCHR1
SCHEMBL14402686 0.82 GPR119 (0.41) GPR119HRH2HRH1MCHR1
SCHEMBL14097623 0.82 GPR119 (0.39) GPR119HRH2HRH1TEAD1TEAD3

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
US-20110003852-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-01-06 US claimed
US-20110003852-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-01-06 US disclosed
US-20110003852-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-01-06 US disclosed
US-20110003852-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-01-06 US disclosed
US-20110003856-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC 2011-01-06 US 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 (2 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-20110003856-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HSD11B1, HSD3B1, HSD17B1 GPR119 453/4885HRH2 496/4885HRH1 271/4885
US-20110003852-A1 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HSD11B1, HSD3B1, HSD17B1 GPR119 453/4885HRH2 496/4885HRH1 271/4885

“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.