SCHEMBL4153142

SCHEMBL4153142

CNCc1cc(Cl)cc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IFNAR1 P17181 1/20 0.45
SLC6A4 P31645 11/20 0.44
SLC6A2 P23975 6/20 0.44
SLC6A3 Q01959 5/20 0.44
PTGS2 P35354 1/20 0.43
KCNH2 Q12809 7/20 0.41
HTR2A P28223 6/20 0.41
ADRB2 P07550 1/20 0.39
CYP2A6 P11509 1/20 0.39
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL27650320 0.83 BCHE (0.43) PTGS2GAA
SCHEMBL1254044 0.79 IFNAR1 (0.49) IFNAR1SLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL28948705 0.79 PTGS2 (0.42) PTGS2HTR2ACYP2A6L3MBTL1
SCHEMBL4153648 0.79 IFNAR1 (0.45) IFNAR1SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL9857923 0.76 KDM4E (0.46) IFNAR1SLC6A4SLC6A2SLC6A3PTGS2
SCHEMBL4161556 0.76 CA1 (0.47) IFNAR1SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL28611445 0.76 L3MBTL1 (0.41) PTGS2HTR2ACYP2A6L3MBTL1
SCHEMBL2769756 0.76 MEN1 (0.40) PTGS2
SCHEMBL2769421 0.76 HTR2A (0.50) PTGS2HTR2ACYP2A6L3MBTL1
SCHEMBL15352016 0.76 L3MBTL1 (0.41) PTGS2HTR2ACYP2A6L3MBTL1

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
CN-100534983-C Cyclic amine derivatives, processes for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LTD (GB) 2009-09-02 CN disclosed
US-20090192194-A1 Cyclic Amine Derivatives, Processes For Their Preparation, And Pharmaceutical Compositions Containing Them ALVARO GIUSEPPE 2009-07-30 US disclosed
US-20070073061-A1 Cyclic amine derivatives, processes for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 2007-03-29 US disclosed
CN-1819995-A Cyclic amine derivatives, processes for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LTD (GB) 2006-08-16 CN 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-20070073061-A1 Cyclic amine derivatives, processes for their preparation, and pharmaceutical compositions containing them SLC6A4, OPRL1, HCRTR1 IFNAR1 977/4885SLC6A4 1/4885SLC6A2 33/4885
US-20090192194-A1 Cyclic Amine Derivatives, Processes For Their Preparation, And Pharmaceutical Compositions Containing Them SLC6A4, OPRL1, HCRTR1 IFNAR1 977/4885SLC6A4 1/4885SLC6A2 33/4885

“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.