SCHEMBL2637893

SCHEMBL2637893

N#Cc1cccc(C(=O)NC23CC4CC(C2)CC(C(N)=O)(C4)C3)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.49
CNR2 P34972 3/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
GLMN Q92990 1/20 0.43
PKM P14618 1/20 0.41
POLB P06746 1/20 0.41
PGR P06401 1/20 0.41
GRM5 P41594 1/20 0.41
TSHR P16473 1/20 0.40
GSK3B P49841 1/20 0.40
HSD11B1 P28845 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
SCHEMBL1578685 0.90 FAAH (0.56) FAAHCNR2KMT2AMEN1ATM
SCHEMBL2637894 0.87 FAAH (0.51) FAAHCNR2KMT2AMEN1ATM
SCHEMBL2639379 0.85 FAAH (0.67) FAAHCNR2KMT2AMEN1ATM
SCHEMBL3376419 0.84 FAAH (0.70) FAAHCNR2KMT2AMEN1ATM
SCHEMBL3377748 0.83 FAAH (0.52) FAAHCNR2KMT2AMEN1ATM
SCHEMBL2638487 0.83 GRM5 (0.53) FAAHCNR2KMT2AMEN1ATM
SCHEMBL2638886 0.83 FAAH (0.73) FAAHCNR2KMT2AMEN1ATM
SCHEMBL2638913 0.82 FAAH (0.67) FAAHCNR2KMT2AMEN1ATM
SCHEMBL3375880 0.82 KMT2A (0.73) FAAHCNR2KMT2AMEN1ATM
SCHEMBL11026888 0.81 GRM5 (0.46) GRM5GSK3B

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 11 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
JP-2011529057-A 2011-12-01 JP claimed
WO-2010011570-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 WO 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 FAAH 2836/4885CNR2 1628/4885KMT2A 3173/4885
US-20130184277-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, PDE3B, ADM2 FAAH 2727/4885CNR2 1603/4885KMT2A 2991/4885
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, ADM2, PDE3B FAAH 2906/4885CNR2 1681/4885KMT2A 3089/4885

“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.