SCHEMBL4307165

SCHEMBL4307165

CCOCc1nc2c(NCc3ccccc3)nc(C)c(C)c2n1NCCCNC(=O)NC(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
EGLN1 Q9GZT9 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
STING1 Q86WV6 1/20 0.34
EPHX2 P34913 6/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
SIRT5 Q9NXA8 1/20 0.33
EGFR P00533 1/20 0.33
ERBB2 P04626 1/20 0.33
SLC26A6 Q9BXS9 1/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL4299585 0.91 ALDH1A1 (0.38) TSHRKDM4EALDH1A1HSD17B10SMN1; SMN2
SCHEMBL4296504 0.83 TLR7 (0.35) KDM4EALDH1A1HSD17B10SMN1; SMN2EGFR
SCHEMBL4296390 0.82 EPHX1 (0.34) TSHRBRD4
SCHEMBL4302557 0.82 TLR7 (0.34) TSHRBRD4
SCHEMBL5410462 0.77 TLR7 (0.51)
SCHEMBL4296234 0.74 CDK1 (0.39) TSHRKDM4EALDH1A1HSD17B10SMN1; SMN2
SCHEMBL4299892 0.72 TLR7 (0.30)
SCHEMBL13663013 0.70 TLR7 (0.45)
SCHEMBL4302627 0.70 RAB9A (0.42) TSHRKDM4EALDH1A1HSD17B10GAA
SCHEMBL19469393 0.69 TLR7 (0.49) SMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS IL2, IL4I1, IFNG TSHR 1892/4885EGLN1 2505/4885KDM4E 3088/4885

“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.