SCHEMBL5855740

SCHEMBL5855740

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.49
HTT P42858 1/20 0.48
THRB P10828 1/20 0.46
PKM P14618 1/20 0.46
KMT2A Q03164 5/20 0.45
MEN1 O00255 3/20 0.45
MAPT P10636 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 1/20 0.43
RECQL P46063 1/20 0.43
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
PRSS1 P07477 1/20 0.38

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
SCHEMBL5856202 1.00 ATM (0.49) ATMHTTTHRBPKMKMT2A
SCHEMBL5855580 1.00 ATM (0.49) ATMHTTTHRBPKMKMT2A
SCHEMBL5857271 0.91 HTT (0.48) ATMHTTTHRBPKMKMT2A
SCHEMBL5858434 0.90 HTT (0.47) ATMHTTTHRBPKMKMT2A
SCHEMBL5855632 0.89 ABCB11 (0.46) ATMHTTTHRBPKMKMT2A
SCHEMBL5856093 0.89 HTT (0.46) ATMHTTTHRBPKMKMT2A
SCHEMBL5857535 0.83 KMT2A (0.41) ATMKMT2AMEN1MAPTCYP4F2
SCHEMBL5856049 0.81 ATM (0.53) ATMHTTTHRBPKMKMT2A
SCHEMBL5855727 0.80 ATM (0.54) ATMHTTTHRBPKMKMT2A
SCHEMBL6741449 0.76 NPC1 (0.48) ATMKMT2AMEN1MAPTMAPK1

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 2463/4885HTT 405/4885THRB 1051/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE ATM 3285/4885HTT 487/4885THRB 1589/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC ATM 3681/4885HTT 417/4885THRB 1161/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC ATM 3681/4885HTT 417/4885THRB 1161/4885

“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.