SCHEMBL835366

SCHEMBL835366

NC(=O)c1cccc2c1C(=O)N(C1CCN(C3CCC3)CC1)C2

nearest known ligand 0.93

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP2 Q9UGN5 7/20 0.93
PARP1 P09874 12/20 0.81
POLB P06746 1/20 0.80
HTT P42858 1/20 0.80
ESR2 Q92731 1/20 0.80

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
SCHEMBL15661314 0.96 PARP2 (1.00) PARP2PARP1POLBHTTESR2
SCHEMBL1882436 0.91 PARP2 (0.81) PARP2PARP1POLBHTTESR2
SCHEMBL6128731 0.91 PARP2 (0.81) PARP2PARP1POLBHTTESR2
SCHEMBL1882438 0.91 PARP2 (0.81) PARP2PARP1POLBHTTESR2
SCHEMBL15661808 0.90 PARP1 (1.00) PARP2PARP1POLBHTTESR2
SCHEMBL6128730 0.90 PARP2 (0.80) PARP2PARP1POLBHTTESR2
SCHEMBL6128729 0.90 PARP2 (0.80) PARP2PARP1POLBHTTESR2
SCHEMBL6128759 0.90 PARP2 (0.80) PARP2PARP1POLBHTTESR2
SCHEMBL834519 0.89 PARP1 (1.00) PARP2PARP1POLBHTTESR2
SCHEMBL15662552 0.89 PARP1 (0.82) PARP2PARP1POLBHTTESR2

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-8143284-B2 2-cyclohexyl-3-oxo-2,3-dihydro-1H-isoindole-4-carboxamide; allergic encephalitis, arthritis, cardiac and kidney toxicities from doxorubicin-based and platinum-based antineoplastic agents, carcinoma of the breast, central nervous system inflammation, cervical carcinoma, ABBOTT LABORATORIES (US) 2012-03-27 US disclosed
US-20080108659-A1 POLY(ADP-RIBOSE)POLYMERASE INHIBITORS ABBVIE INC. 2008-05-08 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-20080108659-A1 POLY(ADP-RIBOSE)POLYMERASE INHIBITORS PARP1, PARP11, PARP2 PARP2 3/4885PARP1 1/4885POLB 20/4885

“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.