SCHEMBL3995484

SCHEMBL3995484

Cc1ccc(C(=O)Nc2[nH]c(COc3ccc(CC(=O)O)cc3)nc2C(N)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
MAPK1 P28482 1/20 0.47
PARP10 Q53GL7 1/20 0.46
NR1H4 Q96RI1 2/20 0.44
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
LMNA P02545 1/20 0.41
SCN2A Q99250 1/20 0.41
RXFP1 Q9HBX9 3/20 0.40
TNIK Q9UKE5 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
SIRT3 Q9NTG7 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL2819406 0.83 L3MBTL1 (0.42) ALDH1A1MAPTMAPK1PARP10MEN1
SCHEMBL2812294 0.81 KDM4E (0.48) MAPTLMNAMEN1KMT2ANPC1
SCHEMBL3989813 0.80 POLB (0.45) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL2816636 0.79 KDM4E (0.46) LMNAMEN1KMT2AMAOBFFAR1
SCHEMBL2817001 0.79 KDM4E (0.46) MAPTNR1H4MEN1KMT2ANPC1
SCHEMBL2815448 0.79 PPARD (0.46) MAOBPTGDR2
SCHEMBL2816392 0.79 KDM4E (0.51) ALDH1A1MAPTMEN1KMT2A
SCHEMBL25718580 0.78 RAB9A (0.49) ALDH1A1MAPTPARP10NR1H4LMNA
SCHEMBL3998867 0.78 PLA2G4B (0.42) ALDH1A1MAPTCYP3A4LMNAMEN1
SCHEMBL2816973 0.78 ALOX5 (0.41) ALDH1A1MAPTMAOBPTGDR2FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362057-B2 Insulin resistance; atherosclerosis; cardiovascular disorders; metabolism disorders MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2013-01-29 US disclosed
EP-1910310-B1 NOVELIMIDAZOLECARBOXAMIDE DERIVATIVES AS FRUCTOSE-1,6-BISPHOSPHATASE INHIBITORS, AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME MERCK PATENT GMBH (DE) 2009-06-03 EP disclosed
US-20080207720-A1 Novel Imidazolecarboxamide Derivatives as Fructose-1,6-Bisphosphatase Inhibitors, and Pharmaceutical Compositions Comprising Same MERCK PATENT GESELLSCHAFT (DE) 2008-08-28 US disclosed
EP-1910310-A1 NOVELIMIDAZOLECARBOXAMIDE DERIVATIVES AS FRUCTOSE-1,6-BISPHOSPHATASE INHIBITORS, AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME Merck Patent GmbH (DE) 2008-04-16 EP disclosed
WO-2007014619-A1 NOVELIMIDAZOLECARBOXAMIDE DERIVATIVES AS FRUCTOSE-1,6-BISPHOSPHATASE INHIBITORS, AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME MERCK PATENT GMBH (DE) 2007-02-08 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 (1 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-20080207720-A1 Novel Imidazolecarboxamide Derivatives as Fructose-1,6-Bisphosphatase Inhibitors, and Pharmaceutical Compositions Comprising Same FBP1, INSR, GPR119 ALDH1A1 478/4885MAPT 3535/4885MAPK1 674/4885

“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.