SCHEMBL408667

SCHEMBL408667

CCOC(=O)c1cn(-c2cccc(Br)c2Cl)nc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 12/20 0.43
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL408707 0.84 PDE4B (0.50) DGAT1KDM4EALDH1A1MAPK1NPSR1
SCHEMBL408204 0.83 DGAT1 (0.41) DGAT1LMNA
SCHEMBL407653 0.82 DGAT1 (0.49) DGAT1KDM4EALDH1A1GAAMAPK1
SCHEMBL407225 0.81 DGAT1 (0.48) DGAT1KDM4EALDH1A1LMNAMAPK1
SCHEMBL442691 0.81 DGAT1 (0.61) DGAT1KDM4EALDH1A1LMNAGAA
SCHEMBL407661 0.79 DGAT1 (0.47) DGAT1KDM4EALDH1A1LMNAGAA
SCHEMBL407229 0.79 DGAT1 (0.45) DGAT1KDM4EALDH1A1LMNACA12
SCHEMBL4486967 0.78 DGAT1 (0.52) DGAT1KDM4EALDH1A1LMNACA12
SCHEMBL408365 0.78 DGAT1 (0.59) DGAT1KDM4EALDH1A1LMNACA12
SCHEMBL24303811 0.78 CA12 (0.56) DGAT1KDM4EALDH1A1LMNACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 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-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT DGAT1 2/4885KDM4E 2452/4885ALDH1A1 272/4885

“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.