SCHEMBL5007464

SCHEMBL5007464

CCN(CC)CCOc1cccc(-c2cc(C(=O)NN3CCCCC3)c(NC(N)=O)s2)c1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 19/20 0.67
CDK2AP1 O14519 4/20 0.67
MAP4K4 O95819 1/20 0.45

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
SCHEMBL4705891 0.82 CHEK1 (0.73) CHEK1CDK2AP1
SCHEMBL4211748 0.81 CHEK1 (0.64) CHEK1CDK2AP1
SCHEMBL4215540 0.81 CHEK1 (0.86) CHEK1CDK2AP1
SCHEMBL4212001 0.80 CHEK1 (1.00) CHEK1CDK2AP1
SCHEMBL4215383 0.80 CHEK1 (0.88) CHEK1CDK2AP1MAP4K4
SCHEMBL4212933 0.80 CHEK1 (0.91) CHEK1CDK2AP1
SCHEMBL4223504 0.80 CHEK1 (0.88) CHEK1CDK2AP1MAP4K4
SCHEMBL4211373 0.79 CHEK1 (0.69) CHEK1CDK2AP1
SCHEMBL4706268 0.78 CHEK1 (0.68) CHEK1CDK2AP1
SCHEMBL5007467 0.78 CHEK1 (0.50) CHEK1CDK2AP1

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-7423061-B2 Substitute thiophenes and uses thereof ASTRAZENECA AB (SE) 2008-09-09 US disclosed
US-20060281666-A1 Substitute thiophenes and uses therof ASTRAZENECA AB (SE) 2006-12-14 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-20060281666-A1 Substitute thiophenes and uses therof TYMP, TPMT, MGMT CHEK1 602/4885CDK2AP1 2225/4885MAP4K4 4690/4885

“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.