SCHEMBL5215707

SCHEMBL5215707

CS(=O)(=O)c1cccc(CNc2nc(Nc3ccc4[nH]cc(C5=CCNCC5)c4c3)ncc2Br)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 14/20 0.60
▸ ULK1 O75385 2/20 0.46
▸ PTK2B Q14289 2/20 0.46
▸ CDK1 P06493 1/20 0.46
▸ CCNB1 P14635 1/20 0.46
▸ CDK7 P50613 1/20 0.46
▸ NTRK1 P04629 3/20 0.40
▸ NUAK1 O60285 2/20 0.40
▸ STK16 O75716 2/20 0.40
▸ CSNK2A2 P19784 2/20 0.40
▸ TYK2 P29597 2/20 0.40
▸ AAK1 Q2M2I8 2/20 0.40
▸ BMP2K Q9NSY1 2/20 0.40
▸ TBK1 Q9UHD2 2/20 0.40
▸ CSF1R P07333 1/20 0.40
▸ ULK3 Q6PHR2 1/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ BMPR2 Q13873 1/20 0.39
▸ NUAK2 Q9H093 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
SCHEMBL5213222 0.91 PTK2 (0.48) PTK2ULK1PTK2BCDK1CCNB1
SCHEMBL5210356 0.90 PTK2 (0.60) PTK2PTK2B
SCHEMBL5213474 0.90 PTK2 (0.61) PTK2ULK1PTK2BCDK1CCNB1
SCHEMBL6209598 0.89 PTK2 (0.44) PTK2CDK1NTRK1NUAK1STK16
SCHEMBL6212141 0.88 KDM4E (0.43) PTK2PTK2BCDK1CCNB1NTRK1
SCHEMBL6212597 0.88 NTRK1 (0.49) PTK2NTRK1
SCHEMBL6242541 0.87 KDM4E (0.50) PTK2NTRK1JAK3
SCHEMBL6236688 0.87 PTK2 (0.42) PTK2PTK2BCDK1CCNB1NTRK1
SCHEMBL6211739 0.87 PTK2 (0.51) PTK2CDK1CCNB1CDK7NTRK1
SCHEMBL6210939 0.87 HTR2C (0.42) PTK2CDK1NTRK1NUAK1STK16

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 3610/4885ULK1 3275/4885PTK2B 3168/4885

“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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