SCHEMBL6507672

SCHEMBL6507672

COC(C)Cc1[nH]nc2c1c(=O)[nH]c1ccc(Cl)cc12

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 7/20 0.60
CDC25A P30304 1/20 0.40
CDC25C P30307 1/20 0.40
ADORA3 P0DMS8 1/20 0.38
CSF1R P07333 3/20 0.38
PTGES O14684 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
LMNA P02545 1/20 0.36
IDH1 O75874 1/20 0.36
CYP1A2 P05177 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL6509924 0.82 CHEK1 (0.70) CHEK1CDC25ACDC25CADORA3CSF1R
SCHEMBL6507557 0.82 CHEK1 (0.62) CHEK1CDC25ACDC25CADORA3CSF1R
SCHEMBL6513915 0.78 CHEK1 (0.60) CHEK1CDC25ACDC25CADORA3CSF1R
SCHEMBL6515387 0.77 CHEK1 (0.59) CHEK1CDC25ACDC25CADORA3CSF1R
SCHEMBL6507585 0.76 CHEK1 (1.00) CHEK1CDC25ACDC25CADORA3CSF1R
SCHEMBL6506900 0.73 CHEK1 (0.68) CHEK1
SCHEMBL6509557 0.72 CHEK1 (0.53) CHEK1ADORA3CSF1RPTGESSIRT1
SCHEMBL6509456 0.71 CHEK1 (0.51) CHEK1ADORA3CSF1RPTGESSIRT1
SCHEMBL6513239 0.70 CHEK1 (0.53) CHEK1LMNAIDH1HPGDALDH1A1
SCHEMBL6510097 0.70 IDH1 (0.41) CHEK1CDC25ACDC25CADORA3CSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050245563-A1 Chk-1 inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-11-03 US disclosed
WO-2005028474-A2 PYRAZOLOQUINOLINE DERIVATIVES AS CHK-1 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-03-31 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-20050245563-A1 Chk-1 inhibitors CHKA, CHKB, CHEK1 CHEK1 3/4885CDC25A 529/4885CDC25C 608/4885

“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.