SCHEMBL3313486

SCHEMBL3313486

CC(=O)N1CCN(c2cc(C)c(Nc3ncc(Cl)c(-c4cnc5ccccn45)n3)cc2F)CC1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.67
KCNH2 Q12809 11/20 0.67
CDK2 P24941 9/20 0.67
INSR P06213 1/20 0.67
CDK1 P06493 1/20 0.57
CDK8 P49336 1/20 0.57
CDK7 P50613 1/20 0.57
CDK9 P50750 1/20 0.57

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
SCHEMBL3318798 0.90 IGF1R (0.77) IGF1RKCNH2CDK2INSR
SCHEMBL3315426 0.87 IGF1R (0.81) IGF1RKCNH2CDK2INSR
SCHEMBL3313159 0.86 IGF1R (0.68) IGF1RKCNH2CDK2INSRCDK1
SCHEMBL3317259 0.86 IGF1R (0.70) IGF1RKCNH2CDK2INSRCDK1
SCHEMBL3317085 0.85 IGF1R (0.78) IGF1RKCNH2CDK2INSR
SCHEMBL3314650 0.84 IGF1R (0.72) IGF1RKCNH2CDK2INSR
SCHEMBL3313036 0.83 IGF1R (0.81) IGF1RKCNH2CDK2INSR
SCHEMBL3314148 0.82 IGF1R (0.72) IGF1RKCNH2CDK2INSR
SCHEMBL3316979 0.82 IGF1R (0.74) IGF1RKCNH2CDK2INSR
SCHEMBL13362116 0.81 IGF1R (0.80) IGF1RKCNH2CDK2INSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 US claimed
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 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-20100105655-A1 NOVEL COMPOUNDS 515 TYMS, ABCG2, UMPS IGF1R 4384/4885KCNH2 3082/4885CDK2 64/4885

“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.