SCHEMBL5646579

SCHEMBL5646579

CC(C)CCCC(C)CC1(C(=O)O)CCC(C)CC1(CC(C)CCCC(C)C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.39
CDC25A P30304 3/20 0.36
CYP1A2 P05177 1/20 0.33
LMNA P02545 1/20 0.32
CDC25B P30305 1/20 0.32
EBP Q15125 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL15240653 0.83 CYP1A2 (0.39) CYP1A2
SCHEMBL5647500 0.82 BLM (0.46) BLMCDC25ALMNACDC25B
SCHEMBL5649554 0.76 CDC25A (0.38) BLMCDC25ACDC25BEBPSIGMAR1
SCHEMBL5644733 0.75 CA2 (0.36) CYP1A2
SCHEMBL5648693 0.74 BLM (0.44) BLMCDC25ALMNA
SCHEMBL5643340 0.69 BLM (0.35) BLM
SCHEMBL5644113 0.69 CYP1A2 (0.31) CYP1A2
SCHEMBL5644635 0.68 CYP1A2 (0.37) CYP1A2
SCHEMBL5646465 0.67 CYP1A2 (0.39) CYP1A2
SCHEMBL5647533 0.67 CYP1A2 (0.36) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7271282-B1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-09-18 US disclosed
US-20050038283-A1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL, CO., LTD. (JP) 2005-02-17 US 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 (1 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-20050038283-A1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester SCO2, PDHX, DECR2 BLM 2289/4885CDC25A 769/4885CYP1A2 677/4885

“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.