SCHEMBL4950092

SCHEMBL4950092

CC(C)(C)OC(=O)n1c(=O)[nH]c2cc(OC(F)(F)F)ccc21

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 2/20 0.42
KCNQ2 O43526 2/20 0.42
KIF11 P52732 1/20 0.40
OPRM1 P35372 1/20 0.40
LIPE Q05469 1/20 0.39
KDM4E B2RXH2 3/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
GPR119 Q8TDV5 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
GSK3B P49841 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
DDR1 Q08345 2/20 0.36
TGM2 P21980 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35

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
SCHEMBL4948766 0.90 KCNQ3 (0.40) KCNQ3KCNQ2KIF11OPRM1LIPE
SCHEMBL4947575 0.82 MAPT (0.50) KIF11KMT2A
SCHEMBL21464105 0.82 DAO (0.52) KMT2AGABRG2GABRB3GABRA5
SCHEMBL14934104 0.81 MEN1 (0.41) KMT2AGABRG2GABRB3GABRA5
SCHEMBL25275524 0.81 DAO (0.54) GPR119GSK3BGABRG2GABRB3GABRA5
SCHEMBL318223 0.80 LMNA (0.45) KMT2AGABRG2GABRB3GABRA5
SCHEMBL4296595 0.80 CDK1 (0.46) GSK3BGABRG2GABRB3GABRA5
SCHEMBL640969 0.80 GABRG2 (0.48) GSK3BGABRG2GABRB3GABRA5
SCHEMBL7214732 0.79 PARP1 (0.45) KIF11KDM4EGAAKMT2A
SCHEMBL10202230 0.78 DAO (0.35) GSK3BGABRG2GABRB3GABRA5

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-20080076810-A1 Benzoureas Having Anti-Diabetic Activity MERCK SHARP & DOHME CORP. 2008-03-27 US disclosed
US-20080076810-A1 Benzoureas Having Anti-Diabetic Activity MERCK SHARP & DOHME CORP. 2008-03-27 US disclosed
US-20080076810-A1 Benzoureas Having Anti-Diabetic Activity MERCK SHARP & DOHME CORP. 2008-03-27 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-20080076810-A1 Benzoureas Having Anti-Diabetic Activity PPARD, PPARG, GPR119 KCNQ3 2625/4885KCNQ2 1714/4885KIF11 4630/4885

“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.