SCHEMBL13197809

SCHEMBL13197809

COc1ccc(CNC(=O)c2nc(NC(=O)Nc3ccc(OC(F)(F)F)cc3)cn2CC2CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.44
NAMPT P43490 4/20 0.44
FAAH O00519 1/20 0.43
LMNA P02545 2/20 0.43
PPARA Q07869 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MCHR1 Q99705 1/20 0.41

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
SCHEMBL13197983 0.94 NAMPT (0.47) EPHX2NAMPTFAAHPPARAMCHR1
SCHEMBL13197818 0.87 NAMPT (0.46) EPHX2NAMPTLMNAPPARASMN1; SMN2
SCHEMBL13197928 0.86 NAMPT (0.49) EPHX2NAMPTFAAH
SCHEMBL13197974 0.86 NAMPT (0.49) EPHX2NAMPTPPARASMN1; SMN2HDAC1
SCHEMBL13197847 0.86 KDM4E (0.51) EPHX2NAMPTLMNAPPARASMN1; SMN2
SCHEMBL13197832 0.86 EPHX2 (0.54) EPHX2NAMPTFAAHLMNAPPARA
SCHEMBL13197839 0.85 NAMPT (0.44) EPHX2NAMPTLMNAPPARASMN1; SMN2
SCHEMBL2569969 0.85 MCHR1 (0.44) EPHX2FAAHMAPTMCHR1
SCHEMBL13197825 0.85 EPHX2 (0.44) EPHX2NAMPTLMNAPPARASMN1; SMN2
SCHEMBL13197816 0.84 EPHX2 (0.45) EPHX2FAAHMAPTMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767704-B2 Antiviral 4-aminocarbonylamino-substituted imidazole compounds AICURIS GMBH & CO. KG (DE) 2010-08-03 US disclosed
US-7767704-B2 Antiviral 4-aminocarbonylamino-substituted imidazole compounds AICURIS GMBH & CO. KG (DE) 2010-08-03 US disclosed
US-20080004275-A1 Antiviral 4-Aminocarbonylamino-Substituted Imidazole Compounds BAYER HEALTHCARE AG (DE) 2008-01-03 US disclosed
US-20080004275-A1 Antiviral 4-Aminocarbonylamino-Substituted Imidazole Compounds BAYER HEALTHCARE AG (DE) 2008-01-03 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-20080004275-A1 Antiviral 4-Aminocarbonylamino-Substituted Imidazole Compounds IRF3, EIF2AK2, ZC3HAV1 EPHX2 3922/4885NAMPT 1354/4885FAAH 3850/4885

“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.