SCHEMBL2586346

SCHEMBL2586346

O=C(Nc1ccc(N2CCNCC2)cc1)c1ccccc1I

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MT-CO2 P00403 1/20 0.59
TDP1 Q9NUW8 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
RAB9A P51151 9/20 0.55
NPC1 O15118 8/20 0.55
MAPT P10636 7/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
ALDH1A1 P00352 4/20 0.55
TP53 P04637 2/20 0.55
MCL1 Q07820 1/20 0.55
GAA P10253 2/20 0.54
MAPK1 P28482 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 2/20 0.54
NPSR1 Q6W5P4 1/20 0.54
TSHR P16473 2/20 0.52
MAPKAPK2 P49137 4/20 0.52
GFER P55789 2/20 0.51
AHR P35869 1/20 0.51

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
SCHEMBL2583420 0.83 TDP1 (0.60) TDP1MEN1KMT2ARAB9ANPC1
SCHEMBL2582475 0.82 CHRNB2 (0.61) MT-CO2TDP1RAB9ANPC1MAPT
SCHEMBL31005758 0.82 TYK2 (0.57) MT-CO2TDP1MEN1KMT2ARAB9A
SCHEMBL532678 0.81 MAPT (0.74) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL24891825 0.79 RAB9A (0.64) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL15943476 0.78 ME2 (0.61) TDP1MEN1KMT2ARAB9ANPC1
SCHEMBL5084566 0.78 USP2 (0.66) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL2585345 0.77 NPY2R (0.61) MT-CO2TDP1MEN1KMT2ARAB9A
SCHEMBL24891707 0.77 NPC1 (0.64) MT-CO2MEN1KMT2ARAB9ANPC1
SCHEMBL2582528 0.76 MAPKAPK2 (0.64) MT-CO2RAB9ANPC1MAPTSMN1; SMN2

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 15 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-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-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
CN-1307156-C Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICA NV (BE) 2007-03-28 CN disclosed
US-7169796-B2 Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICA N.V. (BE) 2007-01-30 US 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
CN-1449382-A Polyarylcarboxamides useful as lipid lowering agents JANSSEN PHARMACEUTICA NV (BE) 2003-10-15 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 (6 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 MT-CO2 3061/4885TDP1 3375/4885MEN1 1707/4885
US-20080125412-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS LIPC, PNLIP, APOB MT-CO2 3061/4885TDP1 3375/4885MEN1 1707/4885
US-20060241113-A1 Polyarylcarboxamides useful as lipid lowering agents LIPC, PNLIP, APOB MT-CO2 3061/4885TDP1 3375/4885MEN1 1707/4885
US-20110269747-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS LIPC, PNLIP, APOB MT-CO2 3061/4885TDP1 3375/4885MEN1 1707/4885
US-20040014971-A1 Polyarylcarboxamides useful as lipid lowering agents SREBF1, LIPC, CPT1A MT-CO2 3420/4885TDP1 1806/4885MEN1 846/4885
US-20070082888-A1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS LIPC, PNLIP, APOB MT-CO2 3061/4885TDP1 3375/4885MEN1 1707/4885

“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.