SCHEMBL13197861

SCHEMBL13197861

COCCOCCCNC(=O)c1nc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1CC1CC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.43
CCR2 P41597 1/20 0.42
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
EPHX2 P34913 14/20 0.41
ALOX5 P09917 6/20 0.41
ALDH1A1 P00352 1/20 0.41
EPHX1 P07099 1/20 0.39
FAAH O00519 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
SCHEMBL13197870 0.90 MCHR1 (0.45) MCHR1CCR2KDM4ETDP1EPHX2
SCHEMBL13197816 0.89 EPHX2 (0.45) MCHR1CCR2KDM4EEPHX2ALDH1A1
SCHEMBL13197916 0.89 MCHR1 (0.48) MCHR1CCR2TDP1EPHX2EPHX1
SCHEMBL13197911 0.88 MCHR1 (0.45) MCHR1CCR2KDM4ETDP1EPHX2
SCHEMBL2569969 0.87 MCHR1 (0.44) MCHR1CCR2KDM4EEPHX2ALDH1A1
SCHEMBL13197905 0.87 MCHR1 (0.42) MCHR1CCR2KDM4ETDP1EPHX2
SCHEMBL13197898 0.87 TP53 (0.44) MCHR1KDM4ETDP1EPHX2ALDH1A1
SCHEMBL13197887 0.86 MCHR1 (0.42) MCHR1CCR2KDM4ETDP1EPHX2
SCHEMBL13197987 0.85 MCHR1 (0.44) MCHR1KDM4EEPHX2ALDH1A1EPHX1
SCHEMBL13197879 0.85 EPHX2 (0.45) MCHR1KDM4ETDP1EPHX2ALOX5

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 MCHR1 4719/4885CCR2 872/4885KDM4E 705/4885

“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.