SCHEMBL13197874

SCHEMBL13197874

CCN(CC)C(=O)CNC(=O)c1nc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1CCOC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.47
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
EPHX2 P34913 7/20 0.42
PRMT3 O60678 1/20 0.42
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.40
FAAH O00519 1/20 0.40
ALDH1A1 P00352 1/20 0.39
P2RY1 P47900 1/20 0.39
RAF1 P04049 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
SCHEMBL13197894 0.86 MCHR1 (0.45) MCHR1KDM4ETDP1EPHX2PRMT3
SCHEMBL13197875 0.85 MCHR1 (0.47) MCHR1KDM4ETDP1EPHX2MAPT
SCHEMBL2571500 0.84 EPHX2 (0.50) MCHR1KDM4ETDP1EPHX2POLB
SCHEMBL13197818 0.83 NAMPT (0.46) MCHR1EPHX2POLB
SCHEMBL13197870 0.82 MCHR1 (0.45) MCHR1KDM4ETDP1EPHX2POLB
SCHEMBL13197869 0.80 MCHR1 (0.43) MCHR1KDM4ETDP1EPHX2P2RY1
SCHEMBL2569011 0.80 NAMPT (0.50) POLBALDH1A1
SCHEMBL13197911 0.79 MCHR1 (0.45) MCHR1KDM4ETDP1EPHX2MAPT
SCHEMBL13197877 0.79 EPHX2 (0.59) MCHR1EPHX2MAPT
SCHEMBL13197884 0.79 MCHR1 (0.43) MCHR1EPHX2MAPTPOLB

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 2 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-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 4719/4885KDM4E 705/4885TDP1 795/4885

“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.