SCHEMBL927718

SCHEMBL927718

CCOC(=O)c1ccc(OCC2CC2)cc1F

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 4/20 0.61
PARP15 Q460N3 3/20 0.61
SCN9A Q15858 2/20 0.54
FFAR4 Q5NUL3 1/20 0.44
PARP2 Q9UGN5 1/20 0.43
CPS1 P31327 2/20 0.43
FFAR1 O14842 3/20 0.42
PPARD Q03181 3/20 0.42
ACACB O00763 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
MAOB P27338 1/20 0.41
CRBN Q96SW2 1/20 0.41

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
SCHEMBL1856415 0.86 PARP10 (0.64) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL13366219 0.84 KDM4E (0.50) CPS1CA12CA1CA2CA7
SCHEMBL927683 0.82 PARP10 (0.68) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL8014781 0.82 PARP10 (0.55) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL8014783 0.82 PARP10 (0.55) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL8020684 0.80 PARP10 (0.53) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL8020689 0.80 PARP10 (0.53) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL8005480 0.79 PARP10 (0.55) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL8005475 0.79 PARP10 (0.55) PARP10PARP15SCN9AFFAR4PARP2
SCHEMBL8021405 0.79 PARP10 (0.52) PARP10PARP15SCN9AFFAR4PARP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015225-A1 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-20 US disclosed
US-20110015225-A1 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-20 US disclosed
US-20110015225-A1 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-20 US disclosed
EP-2261213-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-12-15 EP disclosed
EP-2261213-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-12-15 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-20110015225-A1 Heterocyclic compound MC1R, MCHR1, MCHR2 PARP10 4541/4885PARP15 4553/4885SCN9A 2653/4885

“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.