SCHEMBL6206929

SCHEMBL6206929

CCc1ccc(Nc2c(-c3nnc(NCc4ccccn4)o3)ccc(F)c2F)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 6/20 0.45
CCNE1 P24864 6/20 0.45
CDK2 P24941 6/20 0.45
DBF4 Q9UBU7 6/20 0.45
TUBB4A P04350 12/20 0.42
TUBB P07437 12/20 0.42
TUBA3C P0DPH7 12/20 0.42
TUBA1B P68363 12/20 0.42
TUBA4A P68366 12/20 0.42
TUBB4B P68371 12/20 0.42
TUBB3 Q13509 12/20 0.42
TUBB2A Q13885 12/20 0.42
TUBB8 Q3ZCM7 12/20 0.42
TUBA3E Q6PEY2 12/20 0.42
TUBA1A Q71U36 12/20 0.42
TUBA1C Q9BQE3 12/20 0.42
TUBB6 Q9BUF5 12/20 0.42
TUBB2B Q9BVA1 12/20 0.42
TUBB1 Q9H4B7 12/20 0.42
TRPC5 Q9UL62 1/20 0.37

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
SCHEMBL6406191 0.91 ALDH1A1 (0.38) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6399621 0.85 KDR (0.46) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6399213 0.85 LMNA (0.34) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6208644 0.84 CDC7 (0.46) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6207603 0.84 CDC7 (0.38) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6398977 0.83 KDR (0.34) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6206308 0.83 TRPC5 (0.37) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6207571 0.83 TRPC5 (0.40) CDC7CCNE1CDK2DBF4TUBB4A
SCHEMBL6400416 0.83 KDM4E (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6209514 0.83 TRPC5 (0.38) CDC7CCNE1CDK2DBF4TUBB4A

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-1578736-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL-PHENYLAMINE DERIVATIVES Warner-Lambert Company LLC (US) 2005-09-28 EP claimed
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 US claimed
WO-2004056789-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL PHENYLAMINE DERIVATES WARNER-LAMBERT COMPANY LLC (US) 2004-07-08 WO claimed
EP-1578736-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL-PHENYLAMINE DERIVATIVES Warner-Lambert Company LLC (US) 2005-09-28 EP disclosed
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 US disclosed
WO-2004056789-A1 MEK INHIBITING OXA- AND THIA-DIAZOL-2-YL PHENYLAMINE DERIVATES WARNER-LAMBERT COMPANY LLC (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-20050004186-A1 MEK inhibiting compounds MAPK1, MAP3K1, MAPK3 CDC7 395/4885CCNE1 983/4885CDK2 110/4885

“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.