SCHEMBL6215293

SCHEMBL6215293

NC(c1cccs1)c1nc(Cl)ncc1Br

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
EGFR P00533 1/20 0.32
TOP2A P11388 1/20 0.32
TOP2B Q02880 1/20 0.32
TSHR P16473 1/20 0.31
IDO1 P14902 2/20 0.30
TDO2 P48775 2/20 0.30

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
SCHEMBL6212769 0.75 ALDH1A1 (0.32) HSD17B10TSHR
SCHEMBL3452399 0.73 MAPT (0.39) MAPTHSD17B10EGFRTOP2ATOP2B
SCHEMBL6210264 0.72 SLC6A2 (0.34) MAPTTSHR
SCHEMBL2965386 0.68 ADORA2A (0.50) MAPTHSD17B10TSHR
SCHEMBL3296607 0.68 ALOX5 (0.42) MAPTHSD17B10TSHR
SCHEMBL379851 0.68 MAPT (0.38) MAPTHSD17B10TSHR
Iodide SCHEMBL28780518 0.66 ALOX5 (0.41) MAPTHSD17B10TSHR
SCHEMBL6204712 0.66 ABL1 (0.33)
SCHEMBL3452190 0.66 MAPT (0.38) MAPTHSD17B10EGFRTOP2ATOP2B
SCHEMBL22964601 0.66 ABL1 (0.37)

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 3 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 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 MAPT 4615/4885HSD17B10 816/4885EGFR 68/4885

“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.