SCHEMBL15969593

SCHEMBL15969593

COC(=O)c1cnc(OCC2CC2)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.45
SCN9A Q15858 3/20 0.45
CNR2 P34972 7/20 0.44
SCN5A Q14524 1/20 0.43

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
SCHEMBL15351137 0.86 CNR1 (0.44) CNR1SCN9ACNR2SCN5A
SCHEMBL15351916 0.85 DPP4 (0.50) CNR1SCN9ACNR2SCN5A
SCHEMBL28264256 0.84 GABRA5 (0.47) CNR1CNR2
SCHEMBL28012431 0.84 CNR1 (0.44) CNR1SCN9ACNR2SCN5A
SCHEMBL15968271 0.84 CNR1 (0.43) CNR1SCN9ACNR2
SCHEMBL15350410 0.82 CNR1 (0.40) CNR1SCN9ACNR2SCN5A
SCHEMBL5152841 0.82 DPP4 (0.45)
SCHEMBL2088604 0.80 KDM4E (0.43) CNR2
SCHEMBL1425265 0.79 MAPK1 (0.46)
SCHEMBL2716513 0.77 SCN9A (0.46) SCN9ASCN5A

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 CNR1 445/4885SCN9A 1166/4885CNR2 741/4885

“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.