SCHEMBL5213071

SCHEMBL5213071

FC(F)(F)c1ccccc1CNc1nc(Nc2ccc3[nH]cc(C4=CCNCC4)c3c2)ncc1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 7/20 0.41
▸ CDK1 P06493 1/20 0.41
▸ STAT6 P42226 1/20 0.40
▸ CDC7 O00311 1/20 0.40
▸ MAP4K4 O95819 1/20 0.40
▸ PIM1 P11309 1/20 0.40
▸ PRKACA P17612 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ HIPK2 Q9H2X6 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ IRAK4 Q9NWZ3 1/20 0.40
▸ JAK2 O60674 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ MARK3 P27448 1/20 0.39
▸ PRKCI P41743 1/20 0.39
▸ PRKCD Q05655 1/20 0.39
▸ CAMK2B Q13554 1/20 0.39
▸ CAMK2G Q13555 1/20 0.39
▸ CAMK2D Q13557 1/20 0.39

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
SCHEMBL5216635 0.93 PTK2 (0.45) PTK2STAT6CDC7MAP4K4PIM1
SCHEMBL6211231 0.90 CDK1 (0.43) PTK2CDK1STAT6CDK2JAK2
SCHEMBL6237252 0.89 CDK1 (0.45) PTK2CDK1CDK2JAK2PRKD3
SCHEMBL6212509 0.89 CDK1 (0.50) PTK2CDK1STAT6CDK2JAK2
SCHEMBL6240449 0.89 CDK1 (0.43) PTK2CDK1STAT6CDK2KDM4E
SCHEMBL6239285 0.88 CDK1 (0.42) PTK2CDK1CDK2JAK2PRKD3
SCHEMBL6212354 0.87 JAK2 (0.38) PTK2CDK1JAK2PRKD3MARK3
SCHEMBL6212141 0.87 KDM4E (0.43) PTK2CDK1STAT6CDK2KDM4E
SCHEMBL6243295 0.87 KDM4E (0.45) PTK2CDK1STAT6KDM4EALDH1A1
SCHEMBL6210924 0.87 JAK2 (0.40) PTK2CDK1JAK2PRKD3MARK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758887-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Incorporated (US) 2007-03-07 — — EP claimed
WO-2005111016-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2005-11-24 — — WO claimed
US-20050256111-A1 Pyrimidine derivatives for the treatment of abnormal cell growth PFIZER INC 2005-11-17 — — US claimed
US-7235562-B2 Pyrimidine derivatives for the treatment of abnormal cell growth PFIZER INC (US) 2007-06-26 — — US disclosed
EP-1758887-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Incorporated (US) 2007-03-07 — — EP disclosed
WO-2005111016-A1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2005-11-24 — — WO disclosed
US-20050256111-A1 Pyrimidine derivatives for the treatment of abnormal cell growth PFIZER INC 2005-11-17 — — 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-20050256111-A1 Pyrimidine derivatives for the treatment of abnormal cell growth TYMS, TYMP, CCNA1 PTK2 3610/4885CDK1 27/4885STAT6 2745/4885

“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.

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