SCHEMBL13197879

SCHEMBL13197879

COCCOCCCNC(=O)c1nc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1CCOc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.45
MCHR1 Q99705 2/20 0.41
IGF1R P08069 2/20 0.41
KCNA5 P22460 1/20 0.41
BRD4 O60885 1/20 0.40
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SCN9A Q15858 2/20 0.39
PPARA Q07869 1/20 0.39
ALOX5 P09917 3/20 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
SCHEMBL13197870 0.93 MCHR1 (0.45) EPHX2MCHR1KDM4ETDP1ABL1
SCHEMBL13197898 0.89 TP53 (0.44) EPHX2MCHR1IGF1RKDM4ETDP1
SCHEMBL13197911 0.89 MCHR1 (0.45) EPHX2MCHR1KDM4ETDP1ABL1
SCHEMBL13197880 0.88 EPHX2 (0.43) EPHX2MCHR1IGF1RKCNA5ABL1
SCHEMBL13197820 0.88 EPHX2 (0.46) EPHX2MCHR1IGF1RKCNA5ABL1
SCHEMBL13197884 0.85 MCHR1 (0.43) EPHX2MCHR1IGF1RKCNA5
SCHEMBL13197861 0.85 MCHR1 (0.43) EPHX2MCHR1KDM4ETDP1ALDH1A1
SCHEMBL13197821 0.85 NAMPT (0.51) EPHX2KDM4EALDH1A1
SCHEMBL13197881 0.85 EPHX2 (0.44) EPHX2MCHR1IGF1RKCNA5SCN9A
SCHEMBL13197819 0.85 PPARA (0.46) EPHX2IGF1RPPARA

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 3922/4885MCHR1 4719/4885IGF1R 400/4885

“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.