SCHEMBL5783136

SCHEMBL5783136

O=C(Nc1cccc(Oc2ccccc2)c1)Nc1ncc(C2CCC2)s1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 14/20 0.75
CDK2 P24941 14/20 0.75
CDK5 Q00535 14/20 0.75
CDK5R1 Q15078 1/20 0.54
MAPT P10636 1/20 0.48
EPHX2 P34913 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
USP30 Q70CQ3 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL5782078 0.86 CDK2 (1.00) CCNE1CDK2CDK5CDK5R1MAPT
SCHEMBL5780187 0.86 CCNE1 (0.80) CCNE1CDK2CDK5CDK5R1SMN1; SMN2
SCHEMBL6287288 0.84 CCNE1 (0.62) CCNE1CDK2CDK5MAPTSMN1; SMN2
SCHEMBL6281751 0.81 CDK2 (0.90) CCNE1CDK2CDK5CDK5R1MAPT
SCHEMBL5782445 0.80 CCNE1 (0.69) CCNE1CDK2CDK5CDK5R1MAPT
SCHEMBL6282688 0.78 CCNE1 (0.67) CCNE1CDK2CDK5CDK5R1MAPT
SCHEMBL6285536 0.78 CCNE1 (0.67) CCNE1CDK2CDK5CDK5R1MAPT
SCHEMBL6288023 0.78 CCNE1 (0.66) CCNE1CDK2CDK5MAPTEPHX2
SCHEMBL5780845 0.77 CCNE1 (0.65) CCNE1CDK2CDK5CDK5R1SMN1; SMN2
SCHEMBL5782939 0.77 CCNE1 (0.72) CCNE1CDK2CDK5MAPTEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1256578-B1 Thiazole derivatives and their use as cdk inhibitors PFIZER PROD INC (US) 2006-01-11 EP claimed
US-6720427-B2 USED TO TREAT ABNORMAL CELL GROWTH AND CENTRAL NERVOUS SYSTEM DISORDERS PFIZER INC. 2004-04-13 US claimed
US-20030078252-A1 Thiazole derivatives PFIZER INC. 2003-04-24 US claimed
EP-1256578-A1 Thiazole derivatives and their use as cdk inhibitors Pfizer Products Inc. (US) 2002-11-13 EP claimed
EP-1256578-B1 Thiazole derivatives and their use as cdk inhibitors PFIZER PROD INC (US) 2006-01-11 EP disclosed
US-20040192746-A1 Thiazole derivatives PFIZER INC 2004-09-30 US disclosed
US-6720427-B2 USED TO TREAT ABNORMAL CELL GROWTH AND CENTRAL NERVOUS SYSTEM DISORDERS PFIZER INC. 2004-04-13 US disclosed
US-20030078252-A1 Thiazole derivatives PFIZER INC. 2003-04-24 US disclosed
EP-1256578-A1 Thiazole derivatives and their use as cdk inhibitors Pfizer Products Inc. (US) 2002-11-13 EP 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-20030078252-A1 Thiazole derivatives CDK1, CDKL1, CDK5 CCNE1 112/4885CDK2 10/4885CDK5 3/4885
US-20040192746-A1 Thiazole derivatives CDK1, CDKL1, CDK5 CCNE1 112/4885CDK2 10/4885CDK5 3/4885

“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.