SCHEMBL4986792

SCHEMBL4986792

CCN(C(N)=O)C(=O)[CH]c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.42
ALDH1A1 P00352 4/20 0.42
TSHR P16473 2/20 0.42
GLA P06280 2/20 0.42
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 1/20 0.36
AKR1C3 P42330 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALOX5 P09917 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35

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
SCHEMBL5004389 0.84 GAA (0.41) NPC1L3MBTL1LMNAALDH1A1HPGD
SCHEMBL7656951 0.83 NPC1 (0.66) NPC1L3MBTL1LMNAALDH1A1TSHR
SCHEMBL27350475 0.83 NPC1 (0.66) NPC1L3MBTL1LMNAALDH1A1TSHR
SCHEMBL4206732 0.81 TRPM8 (0.45) NPC1LMNAALDH1A1TSHRKMT2A
SCHEMBL2746463 0.81 L3MBTL1 (0.36) NPC1L3MBTL1LMNAALDH1A1TSHR
SCHEMBL7215103 0.78 L3MBTL1 (0.68) NPC1L3MBTL1LMNAALDH1A1TSHR
SCHEMBL4991698 0.77 L3MBTL1 (0.53) NPC1L3MBTL1LMNAALDH1A1TSHR
SCHEMBL4986055 0.77 NPC1 (0.51) NPC1L3MBTL1LMNAALDH1A1TSHR
SCHEMBL4153008 0.77 NPC1 (0.40) NPC1L3MBTL1LMNAALDH1A1TSHR
SCHEMBL5664570 0.76 ALDH1A1 (0.40) NPC1L3MBTL1ALDH1A1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040132745-A1 Microsomal triglyceride transfer protein inhibitor PFIZER INC 2004-07-08 US claimed
US-7468378-B2 Substituted quinoline compounds PFIZER INC. (US) 2008-12-23 US disclosed
US-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 US disclosed
EP-1716137-A1 SUBSTITUTED QUINOLINE COMPOUNDS Pfizer Products Incorporated (US) 2006-11-02 EP disclosed
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS BERTINATO PETER 2006-10-05 US disclosed
US-20050234099-A1 Substituted quinoline compounds PFIZER INC 2005-10-20 US disclosed
EP-1578725-A1 MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN INHIBITORS Pfizer Products Inc. (US) 2005-09-28 EP disclosed
WO-2005080373-A1 SUBSTITUTED QUINOLINE COMPOUNDS PFIZER PRODUCTS INC. (US) 2005-09-01 WO disclosed
WO-2004056777-A1 MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN INHIBITORS PFIZER PRODUCTS INC. (US) 2004-07-08 WO disclosed
US-20040132745-A1 Microsomal triglyceride transfer protein inhibitor PFIZER INC 2004-07-08 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 (4 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-20040132745-A1 Microsomal triglyceride transfer protein inhibitor MTTP, CETP, APOB NPC1 27/4885L3MBTL1 3319/4885LMNA 2237/4885
US-20050234099-A1 Substituted quinoline compounds APOB, APOL1, MTPN NPC1 32/4885L3MBTL1 1827/4885LMNA 800/4885
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 NPC1 32/4885L3MBTL1 1120/4885LMNA 857/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 NPC1 32/4885L3MBTL1 1120/4885LMNA 857/4885

“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.