SCHEMBL5523140

SCHEMBL5523140

O=Cc1ccc(Cn2nc(C3CCC3)c3c4c(c(=O)[nH]c32)CCCC4)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 11/20 0.40
ADORA3 P0DMS8 3/20 0.40
ADORA2A P29274 2/20 0.38
PARP1 P09874 8/20 0.37
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33

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
SCHEMBL5532007 0.89 ADORA1 (0.39) ADORA1ADORA3ADORA2APARP1
SCHEMBL5517383 0.88 ADORA1 (0.39) ADORA1ADORA3ADORA2APARP1HTR2C
SCHEMBL5522404 0.86 PARP1 (0.46) ADORA1ADORA3ADORA2APARP1
SCHEMBL5522593 0.85 PARP1 (0.38) ADORA1ADORA3ADORA2APARP1
SCHEMBL5534187 0.85 PARP1 (0.38) ADORA1ADORA3ADORA2APARP1
SCHEMBL5526082 0.85 PARP1 (0.45) ADORA1ADORA3ADORA2APARP1
SCHEMBL5528810 0.85 HTR2C (0.43) ADORA1ADORA3ADORA2APARP1HTR2C
SCHEMBL5521518 0.85 PARP1 (0.47) ADORA1ADORA3ADORA2APARP1
SCHEMBL5529526 0.85 PARP1 (0.48) ADORA1ADORA3ADORA2APARP1
SCHEMBL5530509 0.84 PARP1 (0.48) ADORA1ADORA3ADORA2APARP1

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-2468748-B1 Pyrazoloquinolones are potent parp inhibitors ABBVIE INC (US) 2016-05-25 EP disclosed
US-20140213610-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS ABBVIE INC. (US) 2014-07-31 US disclosed
EP-1989204-B1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS ABBVIE INC (US) 2014-05-21 EP disclosed
US-8546368-B2 Pyrazoloquinolones are potent PARP inhibitors ABBVIE INC. (US) 2013-10-01 US disclosed
EP-2468748-A1 Pyrazoloquinolones are potent parp inhibitors Abbott Laboratories (US) 2012-06-27 EP disclosed
US-20070249597-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS ABBVIE INC. 2007-10-25 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 (2 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-20140213610-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS PARP1, PARP2, PARP3 ADORA1 3756/4885ADORA3 3786/4885ADORA2A 3265/4885
US-20070249597-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS PARP1, PARP2, PARP3 ADORA1 3756/4885ADORA3 3786/4885ADORA2A 3265/4885

“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.