Caprolactam

Caprolactam

SCHEMBL388930

N[C@@H](CC(=O)C12CCCN1C(=O)[C@@H]2CC(F)(F)F)Cc1cc(F)c(F)cc1F.O=C1CCCCCN1

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.51
DPP8 Q6V1X1 12/20 0.51
DPP7 Q9UHL4 12/20 0.51
DPP9 Q86TI2 2/20 0.41
KCNH2 Q12809 1/20 0.41
CYP2D6 P10635 1/20 0.40

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
Caprolactam SCHEMBL1846964 0.87 DPP4 (0.50) DPP4DPP8DPP7KCNH2
Caprolactam SCHEMBL4152650 0.85 DPP4 (0.37) DPP4DPP8DPP7
Caprolactam SCHEMBL4145590 0.83 DPP4 (0.38) DPP4DPP8DPP7DPP9KCNH2
Caprolactam SCHEMBL4708253 0.77 DPP4 (0.51) DPP4DPP8DPP7KCNH2
SCHEMBL21067975 0.68 DPP4 (1.00) DPP4DPP8DPP7KCNH2
SCHEMBL388929 0.68 DPP4 (1.00) DPP4DPP8DPP7KCNH2
Hydrochloric Acid SCHEMBL4160735 0.67 DPP4 (0.98) DPP4DPP8DPP7KCNH2
SCHEMBL29196918 0.63 DPP4 (0.87) DPP4DPP8DPP7
SCHEMBL29196920 0.63 DPP4 (0.87) DPP4DPP8DPP7
Hydrochloric Acid SCHEMBL6024683 0.62 DPP4 (0.54) DPP4DPP8DPP7DPP9KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101626-B2 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
EP-2004157-B1 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO ARENA PHARM INC (US) 2011-01-12 EP disclosed
EP-2253311-A2 Use of GPR119 receptor agonists for increasing bone mass and for treating osteoporosis, as well as combination therapy relating thereto Arena Pharmaceuticals, Inc. (US) 2010-11-24 EP disclosed
US-7816364-B2 GRP119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
US-20100190750-A1 GPR119 Receptor Agonists in Methods of Increasing Bone Mass and of Treating Osteoporosis and Other Conditions Characterized by Low Bone Mass, and Combination Therapy Relating Thereto ARENA PHARMACEUTICALS, INC. (US) 2010-07-29 US disclosed
US-20090270422-A1 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. 2009-10-29 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-20100190750-A1 GPR119 Receptor Agonists in Methods of Increasing Bone Mass and of Treating Osteoporosis and Other Conditions Characterized by Low Bone Mass, and Combination Therapy Relating Thereto GPR119, GLP1R, GPR4 DPP4 5/4885DPP8 35/4885DPP7 16/4885
US-20090270422-A1 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto GPR119, GLP1R, GPR4 DPP4 5/4885DPP8 35/4885DPP7 16/4885

“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.