SCHEMBL10112252

SCHEMBL10112252

Cc1ccc(F)cc1N1CC2CN(c3nnc(-c4nnn(CC(=O)O)n4)s3)CC2C1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 16/20 0.61
SCD5 Q86SK9 1/20 0.55

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
SCHEMBL10112207 0.90 SCD (0.55) SCDSCD5
SCHEMBL1394277 0.89 SCD (0.75) SCDSCD5
SCHEMBL10112218 0.89 SCD (0.67) SCDSCD5
SCHEMBL10128725 0.88 SCD (0.59) SCDSCD5
SCHEMBL10112170 0.86 SCD (0.81) SCDSCD5
SCHEMBL10112303 0.83 SCD (0.59) SCDSCD5
SCHEMBL10128553 0.79 SCD (0.53) SCDSCD5
SCHEMBL1394376 0.77 SCD (0.71) SCDSCD5
SCHEMBL10112240 0.77 SCD (0.65) SCD
SCHEMBL10111915 0.76 SCD (0.56) SCDSCD5

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-20120010186-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE MERCK FROSST CANADA LTD. (CA) 2012-01-12 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-20120010186-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE SCD, SCD5, FASN SCD 1/4885SCD5 2/4885

“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.