SCHEMBL2582475

SCHEMBL2582475

O=C(Nc1ccc(N2CCNCC2)cc1)c1ccccc1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.61
CHRNB4 P30926 1/20 0.61
CHRNA3 P32297 1/20 0.61
CHRNA4 P43681 1/20 0.61
NPY2R P49146 3/20 0.61
MT-CO2 P00403 1/20 0.57
MAPKAPK2 P49137 2/20 0.55
ALDH1A1 P00352 5/20 0.54
GAA P10253 3/20 0.54
POLB P06746 1/20 0.54
RAB9A P51151 6/20 0.53
MAPT P10636 5/20 0.53
NPC1 O15118 5/20 0.53
SMN1; SMN2 Q16637 5/20 0.53
TP53 P04637 3/20 0.53
MCL1 Q07820 1/20 0.53
MAPK1 P28482 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL2582528 0.88 MAPKAPK2 (0.64) NPY2RMT-CO2MAPKAPK2ALDH1A1GAA
SCHEMBL2586346 0.82 MT-CO2 (0.59) MT-CO2MAPKAPK2ALDH1A1GAARAB9A
SCHEMBL1173912 0.82 NPY2R (0.65) NPY2RMAPKAPK2MAPTTP53
SCHEMBL532678 0.81 MAPT (0.74) MAPKAPK2ALDH1A1RAB9AMAPTNPC1
SCHEMBL2585953 0.81 MAPT (0.70) CHRNB2CHRNB4CHRNA3CHRNA4NPY2R
SCHEMBL5343204 0.80 CHEK1 (0.59) CHRNB2CHRNB4CHRNA3CHRNA4ALDH1A1
SCHEMBL5084566 0.79 USP2 (0.66) ALDH1A1POLBRAB9AMAPTNPC1
Hydrochloric Acid SCHEMBL3132526 0.78 NPY2R (0.80) CHRNB2CHRNB4CHRNA3CHRNA4NPY2R
SCHEMBL12174418 0.78 NPY2R (0.78) CHRNB2CHRNB4CHRNA3CHRNA4NPY2R
SCHEMBL13085127 0.78 NPY2R (0.61) CHRNB2CHRNB4CHRNA3CHRNA4NPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8354402-B2 Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICA N.V. (BE) 2013-01-15 US disclosed
US-20110269747-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS MEERPOEL LIEVEN 2011-11-03 US disclosed
EP-1317431-B1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS JANSSEN PHARMACEUTICA NV (BE) 2010-10-20 EP disclosed
US-7642378-B2 Lipid lowering biphenylcarboxamides JANSSEN PHARMACEUTICA NV (BE) 2010-01-05 US disclosed
US-7528154-B2 Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICAL N.V. (BE) 2009-05-05 US disclosed
US-20080125412-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS MEERPOEL LIEVEN 2008-05-29 US disclosed
US-20080081813-A1 Lipid Lowering Biphenylcarboxamides JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-03 US disclosed
US-7253157-B2 Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-07 US disclosed
EP-1806341-A2 (+)Phenyl-(4-{4-[(4'-trifluoromethyl-biphenyl-2-carbonyl)-amino]-phenyl}-piperidin-1-yl)-acetic acid methyl ester as lipid lowering agent JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-11 EP disclosed
US-20070082888-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS MEERPOEL LIEVEN 2007-04-12 US disclosed
US-7169796-B2 Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICA N.V. (BE) 2007-01-30 US disclosed
EP-1379515-B1 LIPID LOWERING BIPHENYLCARBOXAMIDES JANSSEN PHARMACEUTICA NV (BE) 2006-12-27 EP disclosed
US-20060241113-A1 Polyarylcarboxamides useful as lipid lowering agents MEERPOEL LIEVEN 2006-10-26 US disclosed
US-20050159402-A1 Polyarylcarboxamides useful as lipid lowering agents MEERPOEL LIEVEN (BE) 2005-07-21 US disclosed
US-6878724-B2 Polyarylcarboxamides useful as lipid lowering agents JANSSEN-PHARMACEUTICA N.V. (BE) 2005-04-12 US disclosed
US-20040014971-A1 Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICA N.V. (BE) 2004-01-22 US disclosed
EP-1379515-A1 LIPID LOWERING BIPHENYLCARBOXAMIDES JANSSEN PHARMACEUTICA N.V. (BE) 2004-01-14 EP disclosed
WO-2002081460-A1 LIPID LOWERING BIPHENYLCARBOXAMIDES JANSSEN PHARMACEUTICA N.V. (BE) 2002-10-17 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 (7 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-20050159402-A1 Polyarylcarboxamides useful as lipid lowering agents LIPC, PNLIP, APOB CHRNB2 4835/4885CHRNB4 4862/4885CHRNA3 4773/4885
US-20080081813-A1 Lipid Lowering Biphenylcarboxamides LIPC, PNLIP, LIPA CHRNB2 4712/4885CHRNB4 4814/4885CHRNA3 4717/4885
US-20080125412-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS LIPC, PNLIP, APOB CHRNB2 4835/4885CHRNB4 4862/4885CHRNA3 4773/4885
US-20060241113-A1 Polyarylcarboxamides useful as lipid lowering agents LIPC, PNLIP, APOB CHRNB2 4835/4885CHRNB4 4862/4885CHRNA3 4773/4885
US-20110269747-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS LIPC, PNLIP, APOB CHRNB2 4835/4885CHRNB4 4862/4885CHRNA3 4773/4885
US-20040014971-A1 Polyarylcarboxamides useful as lipid lowering agents SREBF1, LIPC, CPT1A CHRNB2 4831/4885CHRNB4 4860/4885CHRNA3 4787/4885
US-20070082888-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS LIPC, PNLIP, APOB CHRNB2 4835/4885CHRNB4 4862/4885CHRNA3 4773/4885

“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.