SCHEMBL6209954

SCHEMBL6209954

Brc1cnc(Nc2ccc3[nH]ccc3c2)nc1NCCc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 4/20 0.51
PTK2 Q05397 2/20 0.51
PTK2B Q14289 2/20 0.51
EGFR P00533 2/20 0.51
F2 P00734 2/20 0.45
ULK1 O75385 3/20 0.44
FGFR1 P11362 2/20 0.43
KDR P35968 2/20 0.43
CDK1 P06493 3/20 0.43
SYK P43405 2/20 0.42
JAK3 P52333 1/20 0.42
STK17B O94768 1/20 0.41
STK17A Q9UEE5 1/20 0.41
CDK2 P24941 1/20 0.41

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
SCHEMBL6212362 0.92 PTK2 (0.53) IGF1RPTK2PTK2BEGFRFGFR1
SCHEMBL6211636 0.92 PTK2 (0.44) IGF1RPTK2PTK2BEGFRF2
SCHEMBL6213157 0.90 PTK2 (0.61) IGF1RPTK2PTK2BEGFRULK1
SCHEMBL6210226 0.86 PTK2 (0.61) IGF1RPTK2PTK2BEGFRULK1
SCHEMBL6212279 0.86 CDK1 (0.54) IGF1RPTK2PTK2BFGFR1KDR
SCHEMBL6214288 0.85 PTK2 (0.49) IGF1RPTK2PTK2BFGFR1KDR
SCHEMBL6211620 0.84 PTK2 (0.54) IGF1RPTK2PTK2BFGFR1KDR
SCHEMBL6211846 0.83 EGFR (0.53) IGF1RPTK2PTK2BEGFRULK1
SCHEMBL6211871 0.83 PTK2 (0.53) IGF1RPTK2PTK2BEGFRFGFR1
SCHEMBL6211607 0.82 PTK2 (0.64) IGF1RPTK2PTK2BEGFRFGFR1

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 IGF1R 93/4885PTK2 3004/4885PTK2B 1941/4885

“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.