SCHEMBL1027064

SCHEMBL1027064

OCCc1cccc(Nc2ncc(Cl)c(Nc3cccc(O)c3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PKMYT1 Q99640 1/20 0.59
SYK P43405 8/20 0.56
AURKA O14965 1/20 0.54
CTSC P53634 7/20 0.50
JAK2 O60674 2/20 0.49
JAK3 P52333 2/20 0.49
JAK1 P23458 1/20 0.49
NTRK1 P04629 1/20 0.47

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
SCHEMBL1025466 1.00 PKMYT1 (0.59) PKMYT1SYKAURKACTSCJAK2
SCHEMBL1025214 0.91 SYK (0.65) PKMYT1SYKAURKACTSCJAK2
SCHEMBL1024077 0.91 SYK (0.65) PKMYT1SYKAURKACTSCJAK2
SCHEMBL1025453 0.90 SYK (0.56) PKMYT1SYKAURKACTSCJAK2
SCHEMBL2519190 0.88 PKMYT1 (0.71) PKMYT1SYKAURKACTSCJAK2
SCHEMBL1025775 0.83 CTSC (0.44) SYKCTSCJAK2JAK3JAK1
SCHEMBL1024962 0.82 SYK (0.77) PKMYT1SYKAURKACTSCJAK2
SCHEMBL1935031 0.82 AXL (0.49) SYKCTSCJAK2JAK3JAK1
SCHEMBL2515605 0.81 NTRK1 (0.63) PKMYT1SYKJAK2JAK3JAK1
SCHEMBL28936714 0.81 NTRK1 (0.74) NTRK1

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-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
EP-2274288-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Incyte Corporation (US) 2011-01-19 EP disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 WO disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK PKMYT1 853/4885SYK 46/4885AURKA 53/4885

“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.