SCHEMBL2090353

SCHEMBL2090353

BC(C(=O)Nc1ccc(Cl)c2ccccc12)=C1C2CC3CC1CN(C3)C2

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
NPY5R Q15761 1/20 0.32
SYK P43405 1/20 0.31
CFD P00746 1/20 0.30
NPSR1 Q6W5P4 2/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL2091084 0.84 NPC1 (0.45) KMT2ANPSR1MAPT
SCHEMBL2094174 0.79 GRIN2B (0.40) KMT2AMAPT
SCHEMBL2089950 0.78 NPY5R (0.34) KMT2AATMNPY5RSYKNPSR1
SCHEMBL2091939 0.76 GRIN2B (0.45) KMT2ANPSR1MAPT
SCHEMBL2092086 0.72 NPC1 (0.40) KMT2ATDP1MAPT
SCHEMBL2088778 0.72 KDM4E (0.42) KMT2AMAPT
SCHEMBL2089520 0.71 NPC1 (0.47) KMT2A
SCHEMBL2090183 0.70 EPHX2 (0.39) KMT2ATDP1MAPT
SCHEMBL2091020 0.70 EPHX2 (0.42)
SCHEMBL7912442 0.68 CYP1A2 (0.50) KMT2AATM

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-20120190706-A1 ACETAMIDE AND CARBOXAMIDE DERIVATIVES OF AZAADAMANTANE AND METHODS OF USE THEREOF SCANIO MARC J C (US) 2012-07-26 US disclosed
US-8163914-B2 Modulate neuronal nicotinic receptor activity; attention deficit disorder, Parkinson's, Tourette's, schizophrenia, cognitive deficits, dementia; acute pain, post-surgical pain, chronic pain, inflammatory pain; 2-[1-azatricyclo[3.3.1.13,7]dec-4-ylidene]-N-(4-methylphenyl)acetamide ABBOTT LABORATORIES (US) 2012-04-24 US disclosed
EP-2069346-B1 ACETAMIDE AND CARBOXAMIDE DERIVATIVES OF AZAADAMANTANE AND METHODS OF USE THEREOF ABBOTT LAB (US) 2011-12-21 EP disclosed
US-20080255179-A1 Acetamide and Carboxamide Derivatives of Azaadamantane and Methods of Use Thereof ABBOTT LABORATORIES (US) 2008-10-16 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-20080255179-A1 Acetamide and Carboxamide Derivatives of Azaadamantane and Methods of Use Thereof NAAA, AADAC, CD38 KMT2A 228/4885ATM 3506/4885NPY5R 488/4885
US-20120190706-A1 ACETAMIDE AND CARBOXAMIDE DERIVATIVES OF AZAADAMANTANE AND METHODS OF USE THEREOF NAAA, AADAC, CD38 KMT2A 228/4885ATM 3506/4885NPY5R 488/4885

“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.