SCHEMBL6091047

SCHEMBL6091047

COc1cccc([C@@H]2NC(=O)c3cccc4c3N2CC[C@@H]4N)c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
TRPA1 O75762 1/20 0.39
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
HTR2C P28335 2/20 0.38

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
SCHEMBL6092758 1.00 LMNA (0.39) LMNATRPA1DDB1CRBNHTR2C
SCHEMBL6091425 1.00 LMNA (0.39) LMNATRPA1DDB1CRBNHTR2C
SCHEMBL6092426 1.00 LMNA (0.39) LMNATRPA1DDB1CRBNHTR2C
SCHEMBL6091466 0.91 MTNR1A (0.36)
SCHEMBL6089695 0.91 MTNR1A (0.36)
SCHEMBL6091400 0.91 MTNR1A (0.36)
SCHEMBL6090178 0.91 MTNR1A (0.36)
SCHEMBL6091289 0.89 KDM4E (0.42)
SCHEMBL6092971 0.89 KDM4E (0.42)
SCHEMBL6089444 0.89 KDM4E (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004028-A1 Novel PARP inhibitor MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 US disclosed
EP-1582520-A1 NOVEL PARP INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2005-10-05 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 (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-20060004028-A1 Novel PARP inhibitor PARP1, PARP2, PARP11 LMNA 666/4885TRPA1 3892/4885DDB1 178/4885

“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.