SCHEMBL5857789

SCHEMBL5857789

COC(=O)CCCCC(NC(=O)c1ccccc1)C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.45
PDE4B Q07343 2/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
PADI1 Q9ULC6 2/20 0.45
PADI4 Q9UM07 2/20 0.45
PADI2 Q9Y2J8 2/20 0.45
PADI6 Q6TGC4 1/20 0.45
PADI3 Q9ULW8 1/20 0.45
LMNA P02545 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GAA P10253 1/20 0.44
PRSS1 P07477 2/20 0.43
CTSG P08311 2/20 0.43
CTRB1 P17538 2/20 0.43
CMA1 P23946 2/20 0.43
HPGD P15428 1/20 0.43
HDAC4 P56524 1/20 0.42
MEF2D Q14814 1/20 0.42

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
SCHEMBL5858345 0.96 PADI1 (0.46) PDE4APDE4BPDE4CPDE4DPADI1
SCHEMBL5856865 0.87 LMNA (0.53) PDE4APDE4BPDE4CPDE4DPADI1
SCHEMBL16446817 0.86 CA2 (0.49) PDE4APDE4BPDE4CPDE4DPADI1
SCHEMBL16446815 0.86 CA2 (0.49) PDE4APDE4BPDE4CPDE4DPADI1
SCHEMBL5857173 0.84 MEN1 (0.44) TDP1GAAHPGDMEN1KMT2A
SCHEMBL14254912 0.84 HDAC1 (0.57) LMNAHDAC4MEF2D
SCHEMBL5858324 0.83 LMNA (0.54) PDE4APDE4BPDE4CPDE4DPADI1
SCHEMBL6048079 0.81 KMT2A (0.47) LMNATDP1GAAPRSS1CTSG
SCHEMBL12809901 0.81 PRSS1 (0.56) PDE4APDE4BPDE4CPDE4DPADI1
SCHEMBL11545905 0.81 NAAA (0.57) PDE4APDE4BPDE4CPDE4DPADI1

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 PDE4A 3554/4885PDE4B 3815/4885PDE4C 3575/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE PDE4A 3244/4885PDE4B 3578/4885PDE4C 3405/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC PDE4A 3419/4885PDE4B 3665/4885PDE4C 3682/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC PDE4A 3419/4885PDE4B 3665/4885PDE4C 3682/4885

“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.