SCHEMBL679145

SCHEMBL679145

O=C(NCC1(CC2CC2)CCN(S(=O)(=O)C2CC2)CC1)c1ccc(Cl)cc1Cl

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 20/20 0.82
CYP2C9 P11712 1/20 0.61

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
SCHEMBL3379441 0.90 SLC6A9 (1.00) SLC6A9
SCHEMBL679332 0.87 SLC6A9 (1.00) SLC6A9
SCHEMBL8239374 0.87 SLC6A9 (0.82) SLC6A9
SCHEMBL1820937 0.86 SLC6A9 (0.88) SLC6A9
SCHEMBL14686257 0.83 SLC6A9 (0.73) SLC6A9CYP2C9
SCHEMBL2897170 0.83 SLC6A9 (1.00) SLC6A9
SCHEMBL2901870 0.83 SLC6A9 (0.72) SLC6A9CYP2C9
SCHEMBL23815795 0.83 SLC6A9 (1.00) SLC6A9CYP2C9
SCHEMBL3548889 0.83 SLC6A9 (1.00) SLC6A9CYP2C9
SCHEMBL678963 0.83 SLC6A9 (1.00) SLC6A9CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269782-A1 USE OF NMDA ACTIVITY ENHANCERS TO TREAT HYPERSOMNIA, REDUCED WAKEFULNESS OR REDUCED VIGILANCE MERCK, SHARP & DOHME LTD. (GB) 2011-11-03 US disclosed
EP-1797035-B1 CYCLOPROPYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS MERCK SHARP & DOHME (US) 2010-11-17 EP disclosed
EP-1797035-B1 CYCLOPROPYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS MERCK SHARP & DOHME (US) 2010-11-17 EP disclosed
US-7776886-B2 Cyclopropyl piperidine glycine transporter inhibitors MERCK SHARP & DOHME CORP. (US) 2010-08-17 US disclosed
US-7776886-B2 Cyclopropyl piperidine glycine transporter inhibitors MERCK SHARP & DOHME CORP. (US) 2010-08-17 US disclosed
US-7776886-B2 Cyclopropyl piperidine glycine transporter inhibitors MERCK SHARP & DOHME CORP. (US) 2010-08-17 US disclosed
US-20080108663-A1 Cyclopropyl Piperidine Glycine Transporter Inhibitors MERCK SHARP & DOHME LLC 2008-05-08 US disclosed
US-20080108663-A1 Cyclopropyl Piperidine Glycine Transporter Inhibitors MERCK SHARP & DOHME LLC 2008-05-08 US disclosed
US-20080108663-A1 Cyclopropyl Piperidine Glycine Transporter Inhibitors MERCK SHARP & DOHME LLC 2008-05-08 US disclosed
WO-2006039221-A2 CYCLOPROPYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS MERCK & CO., INC. (US) 2006-04-13 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-20080108663-A1 Cyclopropyl Piperidine Glycine Transporter Inhibitors SLC1A2, SLC1A1, SLC1A3 SLC6A9 31/4885CYP2C9 3548/4885

“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.