SCHEMBL13197862

SCHEMBL13197862

CCOC(=O)NCCNC(=O)c1nc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1CC1CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.45
MAPT P10636 2/20 0.44
POLB P06746 2/20 0.43
EPHX2 P34913 13/20 0.42
FAAH O00519 2/20 0.41
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
EPHX1 P07099 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
SCHEMBL13197984 0.91 MCHR1 (0.50) MCHR1MAPTPOLBEPHX2MEN1
SCHEMBL14793970 0.88 EPHX2 (0.49) MCHR1MAPTPOLBEPHX2EPHX1
SCHEMBL13197987 0.88 MCHR1 (0.44) MCHR1MAPTPOLBEPHX2FAAH
SCHEMBL13197933 0.88 EPHX2 (0.45) MCHR1MAPTEPHX2FAAHMEN1
SCHEMBL2569969 0.88 MCHR1 (0.44) MCHR1MAPTPOLBEPHX2FAAH
SCHEMBL13197875 0.87 MCHR1 (0.47) MCHR1MAPTPOLBEPHX2MEN1
SCHEMBL13197986 0.87 IGF1R (0.42) MCHR1MAPTEPHX2FAAHMEN1
SCHEMBL13197913 0.87 MCHR1 (0.47) MCHR1MAPTPOLBEPHX2MEN1
SCHEMBL13197816 0.87 EPHX2 (0.45) MCHR1MAPTPOLBEPHX2FAAH
SCHEMBL13197975 0.86 MCHR1 (0.51) MCHR1MAPTPOLBEPHX2MEN1

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 4719/4885MAPT 3312/4885POLB 117/4885

“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.