SCHEMBL3886925

SCHEMBL3886925

Cc1cc(C)cc(Nc2nccc(-n3ccnc3N)n2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 1.00
FLT1 P17948 4/20 0.68
FLT4 P35916 4/20 0.68

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
SCHEMBL3888459 0.86 KDR (1.00) KDRFLT1FLT4
SCHEMBL3888686 0.84 KDR (1.00) KDRFLT1FLT4
SCHEMBL7256634 0.82 KDR (0.84) KDRFLT1FLT4
SCHEMBL3888462 0.81 KDR (1.00) KDRFLT1FLT4
SCHEMBL3886479 0.81 KDR (1.00) KDRFLT1FLT4
SCHEMBL3883371 0.80 KDR (1.00) KDRFLT1FLT4
SCHEMBL3883426 0.79 KDR (1.00) KDRFLT1FLT4
SCHEMBL3890292 0.79 KDR (1.00) KDRFLT1FLT4
SCHEMBL3884929 0.78 KDR (1.00) KDRFLT1FLT4
SCHEMBL3897200 0.77 KDR (1.00) KDRFLT1FLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958340-B2 such as N-[3-methyl-5-(trifluoromethyl)phenyl]-4-(2-phenyl-1H-imidazol-1-yl)pyrimidin-2-amine; treating breast cancer; use in combination with estrogen receptor modulators such as tamoxifen and raloxifene MERCK & CO., INC. (US) 2005-10-25 US claimed
US-20040220201-A1 Tyrosine kinase inhibitors MERCK & CO., INC. 2004-11-04 US claimed
WO-2003011836-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-13 WO claimed
EP-2012878-A2 COMBINATION THERAPY FOR DISEASES INVOLVING ANGIOGENESIS Bausch & Lomb Incorporated (US) 2009-01-14 EP disclosed
WO-2007130842-A2 COMBINATION THERAPY FOR DISEASES INVOLVING ANGIOGENESIS BAUSCH & LOMB INCORPORATED (US) 2007-11-15 WO disclosed
US-20070258976-A1 Combination Therapy for Diseases Involving Angiogenesis BAUSCH & LOMB INCORPORATED 2007-11-08 US disclosed
US-6958340-B2 such as N-[3-methyl-5-(trifluoromethyl)phenyl]-4-(2-phenyl-1H-imidazol-1-yl)pyrimidin-2-amine; treating breast cancer; use in combination with estrogen receptor modulators such as tamoxifen and raloxifene MERCK & CO., INC. (US) 2005-10-25 US disclosed
US-20040220201-A1 Tyrosine kinase inhibitors MERCK & CO., INC. 2004-11-04 US disclosed
WO-2003011836-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-13 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 (2 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-20070258976-A1 Combination Therapy for Diseases Involving Angiogenesis VEGFA, FLT4, TEK KDR 5/4885FLT1 4/4885FLT4 2/4885
US-20040220201-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 KDR 5/4885FLT1 4/4885FLT4 7/4885

“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.