SCHEMBL6206191

SCHEMBL6206191

CCC(=O)Nc1ccccc1-c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.69
MAPT P10636 6/20 0.69
SOAT1 P35610 2/20 0.68
L3MBTL1 Q9Y468 3/20 0.62
HTT P42858 3/20 0.62
LMNA P02545 3/20 0.59
RAB9A P51151 3/20 0.59
KCNQ2 O43526 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.58
NPC1 O15118 2/20 0.58
KDM4E B2RXH2 2/20 0.58
GAA P10253 2/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
MAPK1 P28482 1/20 0.57
NPY1R P25929 1/20 0.56

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
SCHEMBL17444748 0.89 PARP14 (0.63) ALDH1A1MAPTSOAT1LMNARAB9A
SCHEMBL5213400 0.87 ALDH1A1 (0.59) ALDH1A1MAPTSOAT1L3MBTL1HTT
SCHEMBL26646514 0.86 SOAT1 (0.78) ALDH1A1MAPTSOAT1L3MBTL1HTT
SCHEMBL5216395 0.84 ALDH1A1 (0.61) ALDH1A1MAPTSOAT1L3MBTL1LMNA
SCHEMBL11741667 0.84 MAPT (0.65) ALDH1A1MAPTSOAT1L3MBTL1HTT
SCHEMBL11842346 0.84 ALDH1A1 (0.53) ALDH1A1MAPTSOAT1L3MBTL1HTT
SCHEMBL8619629 0.82 MAPK1 (0.60) ALDH1A1MAPTHTTLMNARAB9A
SCHEMBL3172180 0.82 HTT (0.62) ALDH1A1MAPTSOAT1L3MBTL1HTT
SCHEMBL28701426 0.82 MAPT (0.67) ALDH1A1MAPTSOAT1L3MBTL1HTT
SCHEMBL789303 0.82 MAPT (0.62) ALDH1A1MAPTSOAT1L3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120214798-A1 Novel Ethanediamone Hepcidine Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-23 US disclosed
US-20120214798-A1 Novel Ethanediamone Hepcidine Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-23 US disclosed
US-20110039827-A1 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-02-17 US disclosed
US-7244847-B2 Benzimidazole compounds ISIS PHARMACEUTICALS, INC. (US) 2007-07-17 US disclosed
EP-1567502-A1 SUBSTITUTED DIHYDROPHENANTHRIDINESUL FONAMIDES Wyeth (US) 2005-08-31 EP disclosed
WO-2004050631-A1 SUBSTITUTED DIHYDROPHENANTHRIDINESUL FONAMIDES WYETH (US) 2004-06-17 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 (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-20110039827-A1 Substituted hydroxamic acids and uses thereof HDAC6, HDAC5, HDAC1 ALDH1A1 1505/4885MAPT 2212/4885SOAT1 3525/4885
US-20120214798-A1 Novel Ethanediamone Hepcidine Antagonists HAMP, SLC40A1, FTH1 ALDH1A1 796/4885MAPT 4745/4885SOAT1 4186/4885

“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.