SCHEMBL13871287

SCHEMBL13871287

Cc1nsc2nc(C(C(C)C)N(CCCN)C(=O)c3ccccc3)n(Cc3ccccc3)c(=O)c12

nearest known ligand 0.92

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.92
KIF23 Q02241 1/20 0.92
MAP1LC3B Q9GZQ8 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C19 P33261 1/20 0.61
KCNH2 Q12809 1/20 0.61

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
Azd-4877 SCHEMBL3867651 0.96 KIF11 (1.00) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
Azd-4877 SCHEMBL360704 0.96 KIF11 (1.00) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
Azd-4877 SCHEMBL360703 0.96 KIF11 (1.00) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
Azd-4877 SCHEMBL3875692 0.95 KIF11 (0.98) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL3865044 0.94 KIF11 (0.88) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL3865042 0.94 KIF11 (0.88) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL3869606 0.94 KIF11 (0.88) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
Azd-4877 SCHEMBL3875689 0.94 KIF11 (0.97) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
Hydrochloric Acid SCHEMBL3868959 0.94 KIF11 (0.87) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
Hydrochloric Acid SCHEMBL3868956 0.93 KIF11 (0.86) KIF11KIF23MAP1LC3BCYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099210-A1 ENANTIOMERS OF SELECTED FUSED HETEROCYCLICS AND USES THEREOF ASTRAZENECA AB (SE) 2009-04-16 US disclosed
US-7498333-B2 Enantiomers of selected fused heterocyclics and uses thereof ASTRAZENECA AB (SE) 2009-03-03 US disclosed
US-20080293744-A1 Enantiomers of Selected Fused Pyrimidones and Uses in the Treatment and Prevention of Cancer ASTRAZENECA AB (SE) 2008-11-27 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 (2 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-20080293744-A1 Enantiomers of Selected Fused Pyrimidones and Uses in the Treatment and Prevention of Cancer DHFR, DPYD, TYMS KIF11 3865/4885KIF23 3813/4885MAP1LC3B 4356/4885
US-20090099210-A1 ENANTIOMERS OF SELECTED FUSED HETEROCYCLICS AND USES THEREOF CYP11B2, HCCS, CYP11B1 KIF11 3171/4885KIF23 3405/4885MAP1LC3B 3465/4885

“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.