SCHEMBL9280646

SCHEMBL9280646

[CH2]CCn1cc(B2OC(C)(C)C(C)(C)O2)cn1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.61
LPL P06858 12/20 0.37
LIPG Q9Y5X9 12/20 0.37
F11 P03951 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.33
DGAT1 O75907 2/20 0.31
ESR2 Q92731 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL1331340 0.87 FFAR1 (0.61) FFAR1LPLLIPGF11IRAK4
SCHEMBL1484925 0.85 FFAR1 (0.60) FFAR1LPLLIPGF11IRAK4
SCHEMBL21275456 0.85 FFAR1 (0.60) FFAR1LPLLIPGF11IRAK4
SCHEMBL13157050 0.85 FFAR1 (0.60) FFAR1LPLLIPGF11IRAK4
SCHEMBL2511129 0.85 FFAR1 (0.60) FFAR1LPLLIPGF11IRAK4
SCHEMBL20759 0.85 FFAR1 (0.64) FFAR1LPLLIPGF11IRAK4
SCHEMBL29808355 0.84 FFAR1 (0.56) FFAR1LPLLIPGF11IRAK4
SCHEMBL17247560 0.84 FFAR1 (0.58) FFAR1LPLLIPGF11IRAK4
SCHEMBL790905 0.83 FFAR1 (0.65) FFAR1LPLLIPGF11IRAK4
SCHEMBL253540 0.83 FFAR1 (0.57) FFAR1LPLLIPGIRAK4DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2646448-B1 MACROCYCLIC KINASE INHIBITORS OSI PHARMACEUTICALS LLC (US) 2017-08-30 EP disclosed
US-9133224-B2 Macrocyclic kinase inhibitors OSI Pharmaceuticals, LLC (US) 2015-09-15 US disclosed
EP-2646448-A1 MACROCYCLIC KINASE INHIBITORS OSI Pharmaceuticals, LLC (US) 2013-10-09 EP disclosed
US-20130261086-A1 MACROCYCLIC KINASE INHIBITORS OSI Pharmaceuticals, LLC (US) 2013-10-03 US disclosed
WO-2012074951-A1 MACROCYCLIC KINASE INHIBITORS OSI Pharmaceuticals, LLC (US) 2012-06-07 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-20130261086-A1 MACROCYCLIC KINASE INHIBITORS PTK2, SRC, PTK2B FFAR1 1692/4885LPL 4298/4885LIPG 3812/4885

“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.