SCHEMBL13638406

SCHEMBL13638406

N#CCc1nc2nc(N3CCC(Oc4ccccc4CF)CC3)sc2c(=O)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 16/20 0.61
TNKS O95271 1/20 0.32
PARP1 P09874 1/20 0.32
PARP2 Q9UGN5 1/20 0.32

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
SCHEMBL4507149 0.87 SCD (0.80) SCD
SCHEMBL13638392 0.81 SCD (0.54) SCD
SCHEMBL13638395 0.81 SCD (0.74) SCD
SCHEMBL13638394 0.77 SCD (0.73) SCD
SCHEMBL4515605 0.76 SCD (1.00) SCD
SCHEMBL3339559 0.76 SCD (0.84) SCD
SCHEMBL14872947 0.74 SCD (0.56) SCD
SCHEMBL14870434 0.73 SCD (0.60) SCD
SCHEMBL13301823 0.73 SCD (0.80) SCD
SCHEMBL3342320 0.73 SCD (0.80) SCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090291955-A1 Azacyclohexane Derivatives as Inhibitors of Stearoyl-Coenzyme a Delta-9 Desaturase MERCK FROSST CANADA LTD. (CA) 2009-11-26 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-20090291955-A1 Azacyclohexane Derivatives as Inhibitors of Stearoyl-Coenzyme a Delta-9 Desaturase SCD, SCD5, SREBF1 SCD 1/4885TNKS 1065/4885PARP1 934/4885

“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.