SCHEMBL13213680

SCHEMBL13213680

Cc1ccc(F)cc1OC1CCN(c2cnc3nc(SCC(=O)O)sc3n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 14/20 0.43
GPR6 P46095 1/20 0.37
SCD5 Q86SK9 1/20 0.36
DCK P27707 1/20 0.36

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
SCHEMBL3020792 0.90 SCD (0.54) SCDSCD5
SCHEMBL3025483 0.79 SCD (0.42) SCDSCD5
SCHEMBL2764141 0.78 SCD (0.49) SCDSCD5
SCHEMBL13213664 0.74 SCD (0.50) SCD
SCHEMBL3009182 0.74 SCD (0.74) SCDSCD5
SCHEMBL2783336 0.67 SCD (0.40) SCDSCD5
SCHEMBL4682397 0.67 EPHX2 (0.46) SCD
SCHEMBL2764334 0.67 SCD (0.57) SCDSCD5
SCHEMBL12402220 0.66 NPC1 (0.42) GPR6
SCHEMBL3336610 0.66 SCD (0.59) 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-20100197692-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE MERCK FROSST CANADA LTD. 2010-08-05 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-20100197692-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE SCD, SCD5, CPT1A SCD 1/4885GPR6 1825/4885SCD5 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.