SCHEMBL983929

SCHEMBL983929

CC(=O)c1ccc(OCC2CC2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 8/20 0.53
PARP15 Q460N3 7/20 0.53
PARP2 Q9UGN5 2/20 0.53
ACACB O00763 4/20 0.45
ACACA Q13085 2/20 0.45
NR1H4 Q96RI1 2/20 0.45
SCN9A Q15858 2/20 0.45
KAT6A Q92794 1/20 0.43
FFAR1 O14842 1/20 0.42

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
SCHEMBL1390989 0.88 PARP10 (0.53) PARP10PARP15PARP2NR1H4SCN9A
SCHEMBL4014416 0.87 PARP10 (0.43) PARP10PARP15PARP2ACACBFFAR1
SCHEMBL1854146 0.85 PARP10 (0.51) PARP10PARP15PARP2ACACBACACA
SCHEMBL7963743 0.84 ALDH1A1 (0.53)
SCHEMBL7963745 0.84 ALDH1A1 (0.53)
SCHEMBL7963747 0.84 ALDH1A1 (0.53)
SCHEMBL3428815 0.84 PARP10 (0.49) PARP10PARP15PARP2ACACBACACA
SCHEMBL27823231 0.83 PARP10 (0.40) PARP10PARP15PARP2ACACBFFAR1
SCHEMBL3325497 0.82 GPR119 (0.52)
SCHEMBL716744 0.82 MAOB (0.55) PARP10PARP15PARP2ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445501-B2 Substituted 7-carboxamido-pyrrolo[3,2-d]pyrimidines TAKEDA GMBH (DE) 2013-05-21 US disclosed
US-20110021479-A1 PYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2011-01-27 US disclosed
EP-2247594-A1 PYRROLOPYRIMIDINECARBOXAMIDES Nycomed GmbH (DE) 2010-11-10 EP disclosed
WO-2009106531-A1 PYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2009-09-03 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-20110021479-A1 PYRROLOPYRIMIDINECARBOXAMIDES PDE5A, PDE3A, PDE2A PARP10 1059/4885PARP15 227/4885PARP2 398/4885

“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.