SCHEMBL13197814

SCHEMBL13197814

Cc1nccn1CCCNC(=O)c1nc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1CC1CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 1/20 0.42
KDR P35968 1/20 0.42
MCHR1 Q99705 2/20 0.41
EPHX2 P34913 13/20 0.40
CCR2 P41597 1/20 0.40
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
ALOX5 P09917 3/20 0.39
FAAH O00519 1/20 0.38
RAF1 P04049 1/20 0.38
MOGAT2 Q3SYC2 1/20 0.38
EPHX1 P07099 1/20 0.38
POLB P06746 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
SCHEMBL13197849 0.89 MCHR1 (0.45) FLT1KDRMCHR1EPHX2RAF1
SCHEMBL13197815 0.87 NAMPT (0.45) MCHR1
SCHEMBL13197816 0.87 EPHX2 (0.45) MCHR1EPHX2CCR2FAAHEPHX1
SCHEMBL13197857 0.87 MCHR1 (0.41) FLT1KDRMCHR1EPHX2CCR2
SCHEMBL13197834 0.87 FLT1 (0.44) FLT1KDRMCHR1EPHX2
SCHEMBL13197842 0.87 FLT1 (0.42) FLT1KDRMCHR1EPHX2CCNC
SCHEMBL13197916 0.86 MCHR1 (0.48) FLT1KDRMCHR1EPHX2CCR2
SCHEMBL13197861 0.85 MCHR1 (0.43) MCHR1EPHX2CCR2ALOX5FAAH
SCHEMBL13197865 0.84 EPHX2 (0.58) EPHX2CCR2
SCHEMBL2569969 0.84 MCHR1 (0.44) MCHR1EPHX2CCR2FAAHEPHX1

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 FLT1 1037/4885KDR 1097/4885MCHR1 4719/4885

“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.