SCHEMBL4882376

SCHEMBL4882376

COCCOCC(=O)Nc1ccc(C#Cc2cccc(NC(=O)Nc3cc(C(C)(C)C)on3)c2)cn1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.50
RAF1 P04049 14/20 0.50
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
FLT3 P36888 1/20 0.44
KDR P35968 1/20 0.44

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
SCHEMBL4716871 0.91 BRAF (0.51) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL4883082 0.91 RAF1 (0.47) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL14164073 0.86 RAF1 (0.50) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL4907627 0.84 MEN1 (0.56) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL14164130 0.82 RAF1 (0.49) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL4717419 0.81 BRAF (0.51) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL4718886 0.80 RAF1 (0.50) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL4883306 0.79 MEN1 (0.57) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL4716313 0.77 KMT2A (0.60) BRAFRAF1MEN1NPC1RAB9A
SCHEMBL4716331 0.77 MEN1 (0.60) BRAFRAF1MEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153838-A1 Compounds Having Tie2 (Tek) Activity ASTRAZENECA AB (SE) 2008-06-26 US disclosed
US-20080153838-A1 Compounds Having Tie2 (Tek) Activity ASTRAZENECA AB (SE) 2008-06-26 US disclosed
EP-1848715-A1 COMPOUNDS HAVING TIE2 (TEK) INHIBITORY ACTIVITY AstraZeneca AB (SE) 2007-10-31 EP disclosed
WO-2006082404-A1 COMPOUNDS HAVING TIE2 (TEK) INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2006-08-10 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-20080153838-A1 Compounds Having Tie2 (Tek) Activity TEK, TIE1, KDR BRAF 2750/4885RAF1 2106/4885MEN1 187/4885

“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.