SCHEMBL5857524

SCHEMBL5857524

CCOC(=O)C(C)(C)OCCCCCCC(NC(=O)c1ccc(C)cc1)C(C)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
CTSG P08311 4/20 0.38
CMA1 P23946 4/20 0.38
PRSS1 P07477 2/20 0.38
CTRB1 P17538 2/20 0.38
HPGD P15428 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36

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
SCHEMBL5856228 0.91 TDP1 (0.38) MAPTTDP1CTSGCMA1PRSS1
SCHEMBL5857551 0.88 PPARG (0.40) CYP4F2CYP4A11MAPTTDP1CTSG
SCHEMBL5855798 0.83 MAPT (0.38) MAPTTDP1CTSGCMA1PRSS1
SCHEMBL5855896 0.82 CTSL (0.41) CTSGCMA1PRSS1CTRB1HPGD
SCHEMBL5856188 0.82 POLB (0.44) CTSGCMA1PRSS1CTRB1MEN1
SCHEMBL5855731 0.81 PRSS1 (0.47) CTSGCMA1PRSS1CTRB1HDAC3
SCHEMBL5855987 0.81 PRSS1 (0.47) CTSGCMA1PRSS1CTRB1HDAC3
SCHEMBL5855758 0.81 PRSS1 (0.47) CTSGCMA1PRSS1CTRB1HDAC3
SCHEMBL5857654 0.80 ALB (0.46) TDP1HPGDALBCA2
SCHEMBL5855597 0.80 KMT2A (0.44) MAPTTDP1HPGDHDAC3HDAC4

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 CYP4F2 633/4885CYP4A11 118/4885MAPT 4793/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE CYP4F2 733/4885CYP4A11 118/4885MAPT 4799/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC CYP4F2 727/4885CYP4A11 126/4885MAPT 4835/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC CYP4F2 727/4885CYP4A11 126/4885MAPT 4835/4885

“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.