SCHEMBL3375780

SCHEMBL3375780

COc1cccc(C(=O)NC23CC4CC(CC(N)(C4)C2)C3)n1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PBK Q96KB5 5/20 0.46
CNR2 P34972 7/20 0.44
FAAH O00519 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
DPP8 Q6V1X1 2/20 0.40
DPP9 Q86TI2 2/20 0.40
PKM P14618 1/20 0.40
GRM5 P41594 1/20 0.39

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
SCHEMBL3375775 0.87 CNR2 (0.42) CNR2FAAHMEN1KMT2APKM
SCHEMBL1578461 0.85 GRM5 (0.50) PBKCNR2DPP8DPP9GRM5
SCHEMBL3378031 0.85 PBK (0.48) PBKCNR2FAAHDPP8DPP9
SCHEMBL1578463 0.85 GRM5 (0.53) CNR2FAAHMEN1KMT2APKM
SCHEMBL2638631 0.84 PBK (0.51) PBKFAAHDPP8DPP9GRM5
SCHEMBL2638228 0.83 PBK (0.48) PBKFAAHDPP8DPP9
SCHEMBL1580677 0.82 GRM5 (0.57) CNR2FAAHMEN1KMT2AGRM5
SCHEMBL3379659 0.82 PBK (0.47) PBKCNR2FAAHDPP8DPP9
SCHEMBL3375828 0.81 PBK (0.45) PBKCNR2FAAHDPP8DPP9
SCHEMBL3377613 0.81 PBK (0.48) PBKCNR2FAAHDPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2310356-B1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME LUNDBECK & CO AS H (DK) 2013-08-14 EP claimed
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 US claimed
US-8716284-B2 Adamantyl diamide derivatives and uses of same H. LUNDBECK A/S (DK) 2014-05-06 US disclosed
EP-2310356-B1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME LUNDBECK & CO AS H (DK) 2013-08-14 EP disclosed
US-20130184277-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2013-07-18 US disclosed
US-8389519-B2 Adamantyl diamide derivatives and uses of same H. LUNDBECK A/S (DK) 2013-03-05 US disclosed
US-20120270873-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2012-10-25 US disclosed
US-8198275-B2 Adamantyl diamide derivatives and uses of same H. LUNDBECK A/S (DK) 2012-06-12 US disclosed
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 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 (3 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-20120270873-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, PDE3B, ADM2 PBK 4394/4885CNR2 1628/4885FAAH 2836/4885
US-20130184277-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, PDE3B, ADM2 PBK 4419/4885CNR2 1603/4885FAAH 2727/4885
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, ADM2, PDE3B PBK 4400/4885CNR2 1681/4885FAAH 2906/4885

“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.