SCHEMBL5071908

SCHEMBL5071908

COc1ccc(C=Cc2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.66
CYP1A1 P04798 3/20 0.66
CYP1B1 Q16678 3/20 0.66
TUBB4A P04350 4/20 0.64
TUBB P07437 4/20 0.64
TUBA3C P0DPH7 4/20 0.64
TUBA1B P68363 4/20 0.64
TUBA4A P68366 4/20 0.64
TUBB4B P68371 4/20 0.64
TUBB3 Q13509 4/20 0.64
TUBB2A Q13885 4/20 0.64
TUBB8 Q3ZCM7 4/20 0.64
TUBA3E Q6PEY2 4/20 0.64
TUBA1A Q71U36 4/20 0.64
TUBA1C Q9BQE3 4/20 0.64
TUBB6 Q9BUF5 4/20 0.64
TUBB2B Q9BVA1 4/20 0.64
TUBB1 Q9H4B7 4/20 0.64
PTGS2 P35354 1/20 0.59
CYP19A1 P11511 2/20 0.56

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
SCHEMBL5071907 1.00 CYP1A2 (0.66) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL2980561 0.86 CYP19A1 (0.74) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL2980565 0.86 CYP19A1 (0.74) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL227066 0.85 TLR9 (0.60) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL227065 0.85 TLR9 (0.60) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL29558601 0.82 TUBB4A (0.57) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL20692982 0.82 TUBB4A (0.57) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL29559134 0.82 TUBB4A (0.57) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL14046248 0.82 CYP19A1 (0.64) CYP1A2CYP1A1CYP1B1TUBB4ATUBB
SCHEMBL17145751 0.81 CYP19A1 (0.48) CYP1A2CYP1A1CYP1B1TUBB4ATUBB

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-RE45907-E1 Functionalized stilbene derivatives as improved vascular targeting agents OXIGENE, INC. (US) 2016-03-01 US claimed
US-RE45907-E1 Functionalized stilbene derivatives as improved vascular targeting agents OXIGENE, INC. (US) 2016-03-01 US disclosed
US-RE45720-E1 Functionalized stilbene derivatives as improved vascular targeting agents OXIGENE, INC. (US) 2015-10-06 US disclosed
US-7384925-B2 2' Hydroxy-3'-bromo-3,4,4',5-tetramethoxy-(Z)-stilbene; antimitotic agent; inhibits the assembly of tubulin into microtubules; anticarcinogenic: solid tumor cancers, neovascularization; tubulin-binding stilbenoid analogs structurally related to combretastatin A-1 and A-4 (extract from willow tree) OXIGENE, INC. (US) 2008-06-10 US disclosed
EP-1438281-A4 FUNCTIONALIZED STILBENE DERIVATIVES AS IMPROVED VASCULAR TARGETING AGENTS OXIGENE INC (US) 2006-04-26 EP disclosed
US-20060035868-A1 Functionalized stilbene derivatives as improved vascular targeting agents MATEON THERAPEUTICS, INC. 2006-02-16 US disclosed
US-6919324-B2 For therapy of solid tumor cancers and other diseases associated with unwanted neovascularization OXIGENE, INC. (US) 2005-07-19 US disclosed
EP-1438281-A2 FUNCTIONALIZED STILBENE DERIVATIVES AS IMPROVED VASCULAR TARGETING AGENTS Oxigene, Inc. (US) 2004-07-21 EP disclosed
US-20030149003-A1 Functionalized stilbene derivatives as improved vascular targeting agents MATEON THERAPEUTICS, INC. 2003-08-07 US disclosed
WO-2003035008-A2 FUNCTIONALIZED STILBENE DERIVATIVES AS IMPROVED VASCULAR TARGETING AGENTS OXIGENE, INC. (US) 2003-05-01 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-20030149003-A1 Functionalized stilbene derivatives as improved vascular targeting agents FLT1, FLT4, KDR CYP1A2 4176/4885CYP1A1 2155/4885CYP1B1 868/4885
US-20060035868-A1 Functionalized stilbene derivatives as improved vascular targeting agents FLT1, FLT4, KDR CYP1A2 4176/4885CYP1A1 2155/4885CYP1B1 868/4885

“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.