SCHEMBL2819274

SCHEMBL2819274

CC(=O)c1ccc(Cc2nc(C(N)=O)c(NC(=O)Nc3ccc(C(F)(F)F)cc3)[nH]2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.43
TBXA2R P21731 1/20 0.41
PTGDR Q13258 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
MTOR P42345 2/20 0.41
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RAB9A P51151 2/20 0.40
MAOB P27338 1/20 0.40
HTT P42858 1/20 0.40
MCHR1 Q99705 1/20 0.40
KCNMA1 Q12791 1/20 0.39
NAMPT P43490 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PKM P14618 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL17957290 0.91 EPHX2 (0.47) EPHX2TBXA2RPTGDRPTGDR2MTOR
SCHEMBL2816965 0.91 EPHX2 (0.53) EPHX2TBXA2RPTGDRPTGDR2MTOR
SCHEMBL2813822 0.90 MAPT (0.43) EPHX2TBXA2RPTGDRPTGDR2MTOR
SCHEMBL2812870 0.90 EPHX2 (0.43) EPHX2TBXA2RPTGDRPTGDR2MTOR
SCHEMBL2813899 0.89 EPHX2 (0.46) EPHX2MTORMAPTMEN1KMT2A
SCHEMBL2815905 0.89 TBXA2R (0.42) EPHX2TBXA2RPTGDRPTGDR2MTOR
SCHEMBL2815908 0.89 EPHX2 (0.44) EPHX2TBXA2RPTGDRPTGDR2MTOR
SCHEMBL2816640 0.88 EPHX2 (0.45) EPHX2MTORMAPTMEN1KMT2A
SCHEMBL2817947 0.87 HIF1A (0.48) EPHX2TBXA2RPTGDRPTGDR2MAPT
SCHEMBL13132987 0.87 SAE1 (0.51) EPHX2MAPTMEN1KMT2ARAB9A

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-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US disclosed
US-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US disclosed
US-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 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-20100249132-A1 IMIDAZOLE DERIVATIVES SDHA, SDHB, TPD52L2 EPHX2 2238/4885TBXA2R 871/4885PTGDR 254/4885

“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.