SCHEMBL13197899

SCHEMBL13197899

CCOC(=O)NCCNC(=O)c1nc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.49
SMN1; SMN2 Q16637 1/20 0.46
MCHR1 Q99705 2/20 0.45
IGF1R P08069 2/20 0.45
PPARA Q07869 3/20 0.44
MAPT P10636 1/20 0.44
TP53 P04637 1/20 0.43
LMNA P02545 1/20 0.42
FPR2 P25090 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
RECQL P46063 1/20 0.41
P2RY1 P47900 1/20 0.41
PPARG P37231 1/20 0.41
CACNA1G O43497 1/20 0.40
CACNA1H O95180 1/20 0.40
CACNA1I Q9P0X4 1/20 0.40
IDH1 O75874 1/20 0.40

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) EPHX2SMN1; SMN2MCHR1IGF1RMAPT
SCHEMBL13197833 0.88 EPHX2 (0.48) EPHX2SMN1; SMN2MCHR1IGF1RPPARA
SCHEMBL13197884 0.88 MCHR1 (0.43) EPHX2MCHR1IGF1RMAPTTP53
SCHEMBL13197913 0.87 MCHR1 (0.47) EPHX2SMN1; SMN2MCHR1MAPTLMNA
SCHEMBL13197875 0.87 MCHR1 (0.47) EPHX2SMN1; SMN2MCHR1MAPTLMNA
SCHEMBL13197836 0.87 IGF1R (0.47) EPHX2SMN1; SMN2MCHR1IGF1RPPARA
SCHEMBL13197975 0.86 MCHR1 (0.51) EPHX2SMN1; SMN2MCHR1MAPTLMNA
SCHEMBL13197917 0.86 MCHR1 (0.48) EPHX2SMN1; SMN2MCHR1IGF1RPPARA
SCHEMBL13197907 0.85 MCHR1 (0.45) EPHX2MCHR1IGF1RMAPTLMNA
SCHEMBL13197862 0.85 MCHR1 (0.45) EPHX2MCHR1MAPT

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 3922/4885SMN1; SMN2 2449/4885MCHR1 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.