SCHEMBL13235909

SCHEMBL13235909

CC(=O)C(C)CCC1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.43
METAP2 P50579 1/20 0.38
HPGD P15428 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
CYP1A2 P05177 1/20 0.35
EPHX1 P07099 1/20 0.34

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
SCHEMBL6987701 0.82 METAP1 (0.46) METAP1METAP2HPGDSIGMAR1CYP1A2
SCHEMBL61275 0.82 METAP1 (0.46) METAP1METAP2HPGDSIGMAR1CYP1A2
SCHEMBL17590498 0.82 METAP1 (0.46) METAP1METAP2HPGDSIGMAR1CYP1A2
SCHEMBL13582 0.80 METAP1 (0.49) METAP1METAP2HPGDSIGMAR1CYP1A2
SCHEMBL931400 0.80 METAP1 (0.49) METAP1METAP2HPGDSIGMAR1CYP1A2
SCHEMBL12631267 0.79 MAPT (0.49) HPGDCYP1A2
SCHEMBL13076173 0.79 METAP1 (0.43) METAP1METAP2HPGDSIGMAR1CYP1A2
SCHEMBL13213986 0.77 CA1 (0.50) HPGD
SCHEMBL13198704 0.77 CA1 (0.50) HPGD
SCHEMBL13235676 0.77 CTSK (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168175-A1 ATPENINS BAYER CROPSCIENCE AG (DE) 2010-07-01 US disclosed
US-20100168175-A1 ATPENINS BAYER CROPSCIENCE AG (DE) 2010-07-01 US disclosed
WO-2010069495-A1 ATPENINS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-06-24 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-20100168175-A1 ATPENINS ATP5ME, ATP5MK, ATP5F1B METAP1 2709/4885METAP2 1833/4885HPGD 623/4885

“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.