SCHEMBL5688946

SCHEMBL5688946

Cc1ccnc(CCc2ccc(OC(=O)N3CCC(COn4ccnc4)CC3)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 0.39
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
P2RX3 P56373 1/20 0.34
LIPE Q05469 2/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
MGLL Q99685 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
HDAC1 Q13547 1/20 0.33

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
SCHEMBL5691308 0.92 GRIN2B (0.40) GRIN2BNOS3NOS1NOS2TLR9
SCHEMBL5688925 0.88 GRIN2B (0.41) GRIN2BTLR9TLR8TLR7P2RX3
SCHEMBL5691076 0.88 NOS1 (0.38) GRIN2BNOS3NOS1NOS2TLR9
SCHEMBL5688040 0.85 GRIN2B (0.42) GRIN2BNOS3NOS1NOS2TLR9
SCHEMBL5690565 0.85 GRIN2B (0.37) GRIN2BMGLL
SCHEMBL5691503 0.83 GRIN2B (0.41) GRIN2BLIPE
SCHEMBL5689126 0.82 GRIN2B (0.42) GRIN2BTLR9TLR8TLR7P2RX3
SCHEMBL5690284 0.82 GRIN2B (0.43) GRIN2BNOS3NOS1NOS2TLR9
SCHEMBL5931437 0.82 GRIN2B (0.43) GRIN2BNOS3NOS1NOS2TLR9
SCHEMBL5689579 0.81 GRIN2B (0.38) GRIN2BLIPEMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060160851-A1 Substituted piperidine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US claimed
US-20060160851-A1 Substituted piperidine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US disclosed
EP-1636207-A1 SUBSTITUTED PIPERIDINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP disclosed
WO-2004111032-A1 SUBSTITUTED PIPERIDINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 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-20060160851-A1 Substituted piperidine carbamates LIPE, PNLIP, LIPC GRIN2B 2588/4885NOS3 444/4885NOS1 646/4885

“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.