SCHEMBL6326318

SCHEMBL6326318

CN1CCCCC1c1noc(CCC(=O)O)n1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.40
CPT1A P50416 9/20 0.39
CPT2 P23786 4/20 0.39
LMNA P02545 2/20 0.38
ATM Q13315 1/20 0.38
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MITF O75030 1/20 0.36
TP53 P04637 1/20 0.36
NCOA3 Q9Y6Q9 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
SCHEMBL6463331 0.96 MIF (0.40) MIFLMNAATMTSHRMITF
SCHEMBL6324329 0.87 MIF (0.45) MIFCPT1ACPT2LMNAHPGD
SCHEMBL6326411 0.83 MIF (0.46) MIFLMNAHPGD
SCHEMBL6463093 0.81 ALDH1A1 (0.42) CPT1ACPT2TSHR
SCHEMBL6332424 0.78 USP7 (0.46) MIFLMNAATMHPGDTSHR
SCHEMBL6333012 0.77 ALDH1A1 (0.45) MIFCPT1ALMNATSHR
SCHEMBL6328563 0.77 LDHA (0.40) MIFLMNAATMTSHRMITF
SCHEMBL6532890 0.77 KDM4E (0.37) CPT1A
SCHEMBL6532894 0.72 KDM4E (0.37) CPT1A
SCHEMBL6328194 0.71 ALDH1A1 (0.42) MIFHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423120-A4 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORP (US) 2005-12-28 EP disclosed
US-6924284-B2 PARP inhibitors ICOS CORPORATION (US) 2005-08-02 US disclosed
CN-1568187-A 2H-2,3-dinitrogen phenodiazine-1-ketone and using method thereof ICOS CORP (US) 2005-01-19 CN disclosed
EP-1423120-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2004-06-02 EP disclosed
US-20040087588-A1 Parp inhibitors ICOS CORPORATION 2004-05-06 US disclosed
WO-2003015785-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2003-02-27 WO 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-20040087588-A1 Parp inhibitors PARP1, PARP2, PARP11 MIF 3556/4885CPT1A 762/4885CPT2 849/4885

“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.