SCHEMBL348469

SCHEMBL348469

Cc1nc(N2CCN(Cc3ccc(C(F)(F)F)nc3)C2=O)sc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCD O00767 14/20 0.58
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
PPARD Q03181 1/20 0.42
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
HDAC1 Q13547 1/20 0.38

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
SCHEMBL348346 0.91 SCD (0.71) SCDPRMT5WDR77PPARD
SCHEMBL242149 0.86 SCD (0.65) SCDHDAC1
SCHEMBL348658 0.84 SCD (0.60) SCD
SCHEMBL348863 0.83 SCD (0.78) SCD
SCHEMBL347662 0.83 SCD (0.77) SCD
SCHEMBL348365 0.83 SCD (0.60) SCD
SCHEMBL242074 0.83 SCD (0.82) SCDHDAC1
SCHEMBL347163 0.83 SCD (0.59) SCD
SCHEMBL348909 0.83 SCD (0.59) SCD
SCHEMBL246011 0.82 SCD (0.62) SCDPPARDHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102007123-B Heterocyclic inhibitors of stearoyl-CoA desaturase NOVARTIS AG 2014-04-30 CN disclosed
US-8318949-B2 Organic compounds NOVARTIS AG (CH) 2012-11-27 US disclosed
US-20120014906-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2012-01-19 US disclosed
US-8049016-B2 Thiazole derivatives which inhibit stearoyl-CoA desaturase enzymes NOVARTIS AG (CH) 2011-11-01 US disclosed
CN-102007123-A Heterocyclic inhibitors of stearoyl-CoA desaturase NOVARTIS AG 2011-04-06 CN disclosed
US-20090264444-A1 Organic compounds XENON PHARMACEUTICALS INC. (CA) 2009-10-22 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 (2 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-20120014906-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 SCD 1/4885PRMT5 1370/4885WDR77 4080/4885
US-20090264444-A1 Organic compounds SCD, SCD5, FADS2 SCD 1/4885PRMT5 1370/4885WDR77 4080/4885

“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.