SCHEMBL5347218

SCHEMBL5347218

COC(=O)Nc1nc2cc([S+]([O-])c3ccc(NC(=O)Nc4cc(Cl)ccc4Cl)cc3)ccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TEK Q02763 12/20 0.53
KDR P35968 12/20 0.53
RAF1 P04049 2/20 0.45
BRAF P15056 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
MMP1 P03956 1/20 0.43
NTRK1 P04629 1/20 0.42
NTRK2 Q16620 1/20 0.42
PDGFRA P16234 1/20 0.42

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
SCHEMBL7099970 0.90 MEN1 (0.47) TEKKDRMEN1KMT2ACA12
SCHEMBL11666743 0.86 LMNA (0.46) TEKKDRMEN1KMT2A
SCHEMBL5357878 0.85 KDR (0.69) TEKKDRRAF1PDGFRA
SCHEMBL5347361 0.85 TEK (0.58) TEKKDRRAF1BRAFMEN1
SCHEMBL5349598 0.81 TEK (0.70) TEKKDRRAF1MMP1
SCHEMBL11663797 0.81 KDR (0.51) TEKKDRRAF1MEN1KMT2A
SCHEMBL5346888 0.80 KDR (0.65) TEKKDRRAF1
SCHEMBL5346091 0.79 KDR (0.61) TEKKDRRAF1PDGFRA
Hydrochloric Acid SCHEMBL5347963 0.79 KDR (0.60) TEKKDRRAF1PDGFRA
Oxfendazole SCHEMBL29409244 0.78 LMNA (0.55) TEKKDRRAF1BRAFMEN1

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-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US claimed
US-20040082583-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2004-04-29 US claimed
US-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US disclosed
US-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US disclosed
US-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US disclosed
US-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US disclosed
US-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US disclosed
US-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US disclosed
US-20040082583-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2004-04-29 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 (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-20070249600-A1 CHEMICAL COMPOUNDS TIE1, KDR, FLT4 TEK 5/4885KDR 2/4885RAF1 764/4885
US-20040082583-A1 Chemical compounds TIE1, KDR, FLT4 TEK 5/4885KDR 2/4885RAF1 764/4885

“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.