SCHEMBL4724722

SCHEMBL4724722

O=C(O)C1CCN(C(=O)O)C1Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
FAAH O00519 1/20 0.40
POLB P06746 1/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
MAPK14 Q16539 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL30076447 0.83 SMN1; SMN2 (0.54) MEN1KMT2ACYP2C19
SCHEMBL23459251 0.83 GBA1 (0.43) TACR3MEN1KMT2ACYP2C9CYP2C19
SCHEMBL5355491 0.83 GBA1 (0.43) TACR3MEN1KMT2ACYP2C9CYP2C19
SCHEMBL6326488 0.83 GBA1 (0.43) TACR3MEN1KMT2ACYP2C9CYP2C19
SCHEMBL23459409 0.83 GBA1 (0.43) TACR3MEN1KMT2ACYP2C9CYP2C19
SCHEMBL23459412 0.83 GBA1 (0.43) TACR3MEN1KMT2ACYP2C9CYP2C19
SCHEMBL15971487 0.81 TACR1 (0.42) TACR3L3MBTL1MEN1KMT2AFAAH
SCHEMBL6325615 0.81 TACR3 (0.44) TACR3MEN1KMT2AFAAHPOLB
SCHEMBL14840505 0.81 TACR1 (0.42) TACR3L3MBTL1MEN1KMT2AFAAH
SCHEMBL5354744 0.81 TACR3 (0.44) TACR3MEN1KMT2AFAAHPOLB

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 8 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
EP-1989204-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS Abbott Laboratories (US) 2008-11-12 EP disclosed
US-20070249597-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS ABBVIE INC. 2007-10-25 US disclosed
WO-2007095628-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS ABBOTT LABORATORIES (US) 2007-08-23 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 (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 TACR3 4778/4885L3MBTL1 3332/4885MEN1 2568/4885
US-20070249597-A1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS PARP1, PARP2, PARP3 TACR3 4778/4885L3MBTL1 3332/4885MEN1 2568/4885

“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.