SCHEMBL15967988

SCHEMBL15967988

C[C@@H](COc1cc2oc(-c3ccc(OCC4CC4)cc3Cl)nc2cn1)NC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 18/20 0.44
ACACA Q13085 13/20 0.44
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 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
SCHEMBL15968922 0.94 ACACB (0.51) ACACBACACACYP3A4CYP2C9
SCHEMBL15969336 0.88 ACACA (0.51) ACACBACACA
SCHEMBL15968684 0.86 ACACB (0.52) ACACBACACA
SCHEMBL15968471 0.85 ACACB (0.44) ACACBACACA
SCHEMBL14908373 0.85 ACACB (0.52) ACACBACACA
SCHEMBL15969125 0.84 ACACB (0.43) ACACBACACA
SCHEMBL15968248 0.84 ACACB (0.51) ACACBACACA
SCHEMBL15968374 0.83 ACACB (0.51) ACACBACACA
SCHEMBL15968567 0.83 ACACB (0.42) ACACBACACA
SCHEMBL15968177 0.82 ACACB (0.49) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
EP-2772485-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-09-03 EP disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 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-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 ACACB 1112/4885ACACA 670/4885CYP3A4 364/4885

“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.