Gw631581B

Gw631581B

SCHEMBL5478552

COc1cc(Nc2ncc(-c3ccccc3)o2)cc(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 1.00
FLT1 P17948 10/20 1.00
FLT4 P35916 10/20 1.00
VCP P55072 2/20 0.60
IMPDH2 P12268 6/20 0.60

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
SCHEMBL5477528 0.84 VCP (0.80) KDRFLT1FLT4VCPIMPDH2
Gw627512B SCHEMBL5477421 0.84 KDR (1.00) KDRFLT1FLT4VCPIMPDH2
SCHEMBL2926789 0.83 KDR (0.71) KDRFLT1FLT4VCPIMPDH2
SCHEMBL6329220 0.81 KDR (0.79) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5480404 0.81 KDR (0.97) KDRFLT1FLT4VCPIMPDH2
Gw549390X SCHEMBL3295009 0.80 KDR (1.00) KDRFLT1FLT4VCPIMPDH2
SCHEMBL31061190 0.80 KDR (1.00) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5481691 0.79 KDR (0.73) KDRFLT1FLT4VCPIMPDH2
SCHEMBL31060643 0.79 KDR (0.97) KDRFLT1FLT4VCPIMPDH2
SCHEMBL5232183 0.79 KDR (0.97) KDRFLT1FLT4VCPIMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288515-A1 Chemical compounds SMITHLINE BEECHAM CORPORATION 2005-12-29 US claimed
US-20050228031-A1 Tyrosine kinase inhibitors BILODEAU MARK T 2005-10-13 US claimed
US-20070142437-A1 CHEMICAL COMPOUNDS BROWN MATTHEW L 2007-06-21 US disclosed
US-20070142437-A1 CHEMICAL COMPOUNDS BROWN MATTHEW L 2007-06-21 US disclosed
US-20070142437-A1 CHEMICAL COMPOUNDS BROWN MATTHEW L 2007-06-21 US disclosed
US-7189712-B2 1,3-Oxazole compounds for the treatment of cancer SMITHKLINE BEECHAM CORPORATION (US) 2007-03-13 US disclosed
US-7189712-B2 1,3-Oxazole compounds for the treatment of cancer SMITHKLINE BEECHAM CORPORATION (US) 2007-03-13 US disclosed
US-7189712-B2 1,3-Oxazole compounds for the treatment of cancer SMITHKLINE BEECHAM CORPORATION (US) 2007-03-13 US disclosed
US-20050288515-A1 Chemical compounds SMITHLINE BEECHAM CORPORATION 2005-12-29 US disclosed
US-20050228031-A1 Tyrosine kinase inhibitors BILODEAU MARK T 2005-10-13 US 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 (3 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-20070142437-A1 CHEMICAL COMPOUNDS CDK4, CDK2, CDK3 KDR 33/4885FLT1 56/4885FLT4 47/4885
US-20050228031-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 KDR 5/4885FLT1 4/4885FLT4 7/4885
US-20050288515-A1 Chemical compounds CDK4, CDK2, CDK3 KDR 33/4885FLT1 56/4885FLT4 47/4885

“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.