SCHEMBL6717347

SCHEMBL6717347

Cn1nc(CCCBr)c(N)c1C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
TERT O14746 5/20 0.34
DAPK3 O43293 1/20 0.31
PRKD3 O94806 1/20 0.31
MAP4K4 O95819 1/20 0.31
PRKACA P17612 1/20 0.31
LTK P29376 1/20 0.31
KDR P35968 1/20 0.31
MAP2K2 P36507 1/20 0.31
MAPK8 P45983 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CDK8 P49336 1/20 0.31
CLK2 P49760 1/20 0.31
CDK9 P50750 1/20 0.31
CDK5 Q00535 1/20 0.31
MAP2K1 Q02750 1/20 0.31
PRKCQ Q04759 1/20 0.31
ACVR1 Q04771 1/20 0.31
ROCK1 Q13464 1/20 0.31
DYRK1A Q13627 1/20 0.31

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
SCHEMBL617 0.82 SMN1; SMN2 (0.61) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
Hydrochloric Acid SCHEMBL7813040 0.81 SMN1; SMN2 (0.60) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL6446624 0.78 SMN1; SMN2 (0.49) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL13742735 0.77 SMN1; SMN2 (0.46) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL7008426 0.74 SMN1; SMN2 (0.42) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL8055642 0.73 SMN1; SMN2 (0.48) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL6361850 0.72 SMN1; SMN2 (0.50) SMN1; SMN2TERTKDM4E
SCHEMBL16972520 0.71 SMN1; SMN2 (0.87) SMN1; SMN2TERT
SCHEMBL31735543 0.71 SMN1; SMN2 (0.37) SMN1; SMN2DAPK3PRKD3MAP4K4PRKACA
SCHEMBL30237200 0.70 SMN1; SMN2 (0.44) SMN1; SMN2TERTKDM4E

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-20040023290-A1 Novel therapeutic agents that modulate enzymatic processes THERAVANCE BIOPHARMA R&D IP, LLC 2004-02-05 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-20040023290-A1 Novel therapeutic agents that modulate enzymatic processes RNASE1, ENGASE, ENTPD5 SMN1; SMN2 4046/4885TERT 3990/4885DAPK3 1720/4885

“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.