SCHEMBL5856049

SCHEMBL5856049

CCOC(=O)CCCCC(NC(=O)c1ccccc1)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.53
THRB P10828 1/20 0.50
PKM P14618 1/20 0.50
HTT P42858 1/20 0.49
ALDH1A1 P00352 2/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 2/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 2/20 0.46
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
TBXAS1 P24557 3/20 0.43

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
SCHEMBL5855727 0.96 ATM (0.54) ATMTHRBPKMHTTALDH1A1
SCHEMBL5856022 0.86 THRB (0.48) ATMTHRBPKMHTTALDH1A1
SCHEMBL5856202 0.81 ATM (0.49) ATMTHRBPKMHTTALDH1A1
SCHEMBL5855740 0.81 ATM (0.49) ATMTHRBPKMHTTALDH1A1
SCHEMBL5855580 0.81 ATM (0.49) ATMTHRBPKMHTTALDH1A1
SCHEMBL621763 0.79 ALDH1A1 (0.52) ATMALDH1A1RECQLKMT2AMEN1
SCHEMBL18196123 0.78 MAPK1 (0.48) ATMTHRBPKMALDH1A1RECQL
SCHEMBL6741449 0.78 NPC1 (0.48) ATMALDH1A1RECQLKMT2AMEN1
SCHEMBL11088503 0.77 HTT (0.82) ATMTHRBPKMHTTALDH1A1
SCHEMBL5857531 0.76 THRB (0.51) ATMTHRBPKMHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144906-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-12-05 US disclosed
US-7030143-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-18 US disclosed
US-7022723-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-04 US disclosed
EP-1634876-A2 Heterocyclic compounds for the treatment of hyperlipidemia agents Nippon Shinyaku Co., Ltd. (JP) 2006-03-15 EP disclosed
US-6998412-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-02-14 US disclosed
US-20050009892-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2005-01-13 US disclosed
US-20050009785-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2005-01-13 US disclosed
US-20040162325-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2004-08-19 US disclosed
US-20030166697-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2003-09-04 US disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 EP 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-20050009785-A1 Heterocyclic compounds LIPC, GPR119, APOB ATM 2463/4885THRB 1051/4885PKM 2799/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE ATM 3285/4885THRB 1589/4885PKM 3109/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC ATM 3681/4885THRB 1161/4885PKM 3595/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC ATM 3681/4885THRB 1161/4885PKM 3595/4885

“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.