SCHEMBL2815908

SCHEMBL2815908

NC(=O)c1nc(Cc2ccc(C(=O)NCO)cc2)[nH]c1NC(=O)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.44
MCHR1 Q99705 1/20 0.43
MTOR P42345 3/20 0.40
NAMPT P43490 1/20 0.40
TBXA2R P21731 1/20 0.40
PTGDR Q13258 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
PPARA Q07869 1/20 0.39
PTGS1 P23219 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CNR1 P21554 1/20 0.39
RORC P51449 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
SCHEMBL2812870 0.90 EPHX2 (0.43) EPHX2MCHR1MTORTBXA2RPTGDR
SCHEMBL2816965 0.89 EPHX2 (0.53) EPHX2MTORNAMPTTBXA2RPTGDR
SCHEMBL2819274 0.89 EPHX2 (0.43) EPHX2MCHR1MTORNAMPTTBXA2R
SCHEMBL2817947 0.88 HIF1A (0.48) EPHX2NAMPTTBXA2RPTGDRPTGDR2
SCHEMBL2813899 0.87 EPHX2 (0.46) EPHX2MTORNAMPTPTGS1CA1
SCHEMBL2813822 0.87 MAPT (0.43) EPHX2MCHR1MTORNAMPTTBXA2R
SCHEMBL2816640 0.86 EPHX2 (0.45) EPHX2MTORNAMPTCA1CA2
SCHEMBL2813625 0.85 KMT2A (0.46) NAMPTCA2
SCHEMBL2815905 0.85 TBXA2R (0.42) EPHX2MCHR1MTORNAMPTTBXA2R
SCHEMBL2816401 0.84 EPHX2 (0.42) EPHX2MCHR1NAMPTCA1CA2

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
EP-2193122-B1 IMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2016-08-03 EP claimed
US-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US claimed
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 2238/4885MCHR1 4238/4885MTOR 1794/4885

“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.