SCHEMBL16697602

SCHEMBL16697602

Cc1onc(-c2ccccc2Cl)c1C(=O)ON=C(N)c1cccc(Br)c1

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 11/20 0.82
LMNA P02545 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
ALDH1A1 P00352 4/20 0.60
MAPT P10636 3/20 0.60
SMN1; SMN2 Q16637 1/20 0.58
HSD17B10 Q99714 1/20 0.56
POLB P06746 1/20 0.55
HPGD P15428 1/20 0.55

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
SCHEMBL16697597 1.00 ADORA3 (0.82) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16698091 0.88 ADORA3 (0.81) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16698094 0.88 ADORA3 (0.81) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16697599 0.83 MAPT (0.58) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16697866 0.82 ADORA3 (0.80) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16697869 0.82 ADORA3 (0.80) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16698083 0.77 MAPT (0.62) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16698080 0.77 MAPT (0.62) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16698037 0.77 ADORA3 (0.71) ADORA3LMNATDP1ALDH1A1MAPT
SCHEMBL16698040 0.77 ADORA3 (0.71) ADORA3LMNATDP1ALDH1A1MAPT

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-20150133495-A1 Substituted Acyloxyamidines as HCV NS3/4A Inhibitors VIROCURA THERAPEUTICS INC (CA) 2015-05-14 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-20150133495-A1 Substituted Acyloxyamidines as HCV NS3/4A Inhibitors EIF2AK2, GTF3C4, GTF3C1 ADORA3 2615/4885LMNA 4687/4885TDP1 3191/4885

“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.