SCHEMBL6212988

SCHEMBL6212988

Brc1cnc(Nc2ccc3[nH]ncc3c2)nc1NCc1ccccn1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 8/20 0.75
▸ PTK2B Q14289 6/20 0.75
▸ KDR P35968 4/20 0.54
▸ IGF1R P08069 3/20 0.54
▸ FGFR1 P11362 2/20 0.54
▸ EGFR P00533 1/20 0.52
▸ IDO1 P14902 1/20 0.47
▸ TDO2 P48775 1/20 0.47
▸ CDC7 O00311 1/20 0.45
▸ ULK1 O75385 1/20 0.45
▸ CDK1 P06493 1/20 0.44
▸ SYK P43405 1/20 0.44
▸ MKNK1 Q9BUB5 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
SCHEMBL6209186 0.92 PTK2 (0.64) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6210226 0.90 PTK2 (0.61) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6209907 0.88 PTK2 (0.75) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6213528 0.88 PTK2 (0.78) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6241400 0.88 PTK2 (0.75) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6213157 0.86 PTK2 (0.61) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6257378 0.85 PTK2 (1.00) PTK2PTK2BCDC7ULK1
SCHEMBL6210394 0.84 PTK2 (0.60) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6212019 0.83 PTK2 (0.61) PTK2PTK2BKDRIGF1RFGFR1
SCHEMBL6209807 0.83 PTK2 (0.66) PTK2PTK2BKDRIGF1RFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578732-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Inc. (US) 2005-09-28 — — EP claimed
US-20040220177-A1 Compound for the treatment of abnormal cell growth PFIZER INC 2004-11-04 — — US claimed
WO-2004056786-A2 PYRIMIDINE DERIVATES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2004-07-08 — — WO claimed
EP-1578732-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Inc. (US) 2005-09-28 — — EP disclosed
US-20040220177-A1 Compound for the treatment of abnormal cell growth PFIZER INC 2004-11-04 — — US disclosed
WO-2004056786-A2 PYRIMIDINE DERIVATES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2004-07-08 — — WO 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-20040220177-A1 Compound for the treatment of abnormal cell growth CCNA1, CCNB1, CCNT1 PTK2 3004/4885PTK2B 1941/4885KDR 741/4885

“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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