SCHEMBL13197811

SCHEMBL13197811

CCCCn1cc(NC(=O)Nc2ccc(Cl)cc2C)nc1C(=O)NCCNC(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 4/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SLC6A3 Q01959 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CNR1 P21554 1/20 0.36
TP53 P04637 1/20 0.36
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPK8 P45983 1/20 0.35

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
SCHEMBL13197798 0.87 P2RX7 (0.45) SMN1; SMN2MAPTL3MBTL1TP53
SCHEMBL13197785 0.87 MAPT (0.38) EPHX2SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL13197780 0.86 CHRM1 (0.36) SMN1; SMN2MAPTNPC1RAB9ASLC6A3
SCHEMBL13197804 0.86 L3MBTL1 (0.36) SMN1; SMN2MAPTNPC1RAB9ASLC6A3
SCHEMBL13197808 0.86 SLC6A3 (0.37) SMN1; SMN2MAPTNPC1RAB9ASLC6A3
SCHEMBL1595904 0.85 MAPT (0.42) SMN1; SMN2MAPTNPC1RAB9ASLC6A3
SCHEMBL13197805 0.83 MAPT (0.39) SMN1; SMN2MAPTNPC1RAB9ASLC6A3
SCHEMBL13197812 0.83 KMT2A (0.49) EPHX2SMN1; SMN2MAPTL3MBTL1ALDH1A1
SCHEMBL13197927 0.80 LMNA (0.46) SMN1; SMN2MAPTNPC1ALDH1A1GAA
SCHEMBL13197783 0.79 SLC6A3 (0.39) SMN1; SMN2MAPTNPC1RAB9ASLC6A3

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 2449/4885MAPT 3312/4885

“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.