SCHEMBL348644

SCHEMBL348644

Cc1nc(N2CC(C)N(Cc3cc(F)cc(F)c3)C2=O)sc1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCD O00767 14/20 0.54
HTR1A P08908 2/20 0.37
ACHE P22303 1/20 0.34
PIK3CD O00329 1/20 0.34
CYP3A4 P08684 1/20 0.34
PIK3CB P42338 1/20 0.34

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
SCHEMBL348643 1.00 SCD (0.54) SCDHTR1AACHEPIK3CDCYP3A4
SCHEMBL348617 0.91 SCD (0.43) SCDACHEPIK3CDPIK3CB
SCHEMBL348616 0.91 SCD (0.43) SCDACHEPIK3CDPIK3CB
SCHEMBL348102 0.90 SCD (0.68) SCDHTR1A
SCHEMBL348101 0.90 SCD (0.68) SCDHTR1A
SCHEMBL348702 0.90 SCD (0.68) SCDHTR1A
SCHEMBL348326 0.83 SCD (0.54) SCD
SCHEMBL348327 0.83 SCD (0.54) SCD
SCHEMBL347514 0.81 SCD (0.59) SCD
SCHEMBL347513 0.81 SCD (0.59) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8049016-B2 Thiazole derivatives which inhibit stearoyl-CoA desaturase enzymes NOVARTIS AG (CH) 2011-11-01 US claimed
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
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 1/4885HTR1A 2299/4885ACHE 639/4885
US-20090264444-A1 Organic compounds SCD, SCD5, FADS2 SCD 1/4885HTR1A 2299/4885ACHE 639/4885

“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.