SCHEMBL12336249

SCHEMBL12336249

COc1ccc2c(Oc3cccc(-c4nnc(Nc5cccc(C(F)(F)F)c5)[nH]4)c3)ccnc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 1/20 0.49
▸ GSK3B P49841 1/20 0.49
▸ KDR P35968 8/20 0.48
▸ GAK O14976 1/20 0.47
▸ ABCG2 Q9UNQ0 3/20 0.46
▸ BRAF P15056 4/20 0.45
▸ MAPK14 Q16539 2/20 0.45
▸ TNNI3K Q59H18 1/20 0.45
▸ SYK P43405 1/20 0.43
▸ AXL P30530 1/20 0.42
▸ RAF1 P04049 1/20 0.42
▸ EGFR P00533 1/20 0.41
▸ MET P08581 3/20 0.41
▸ AURKA O14965 2/20 0.41
▸ TEK Q02763 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ PIK3CA P42336 1/20 0.40
▸ CLK2 P49760 1/20 0.40
▸ IRAK1 P51617 1/20 0.40
▸ NEK4 P51957 1/20 0.40

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
SCHEMBL12336454 0.93 GAK (0.51) GSK3AGSK3BKDRGAKABCG2
SCHEMBL12336406 0.93 GSK3A (0.50) GSK3AGSK3BKDRGAKABCG2
SCHEMBL12336578 0.92 BRAF (0.46) GSK3AGSK3BKDRGAKABCG2
SCHEMBL12336459 0.92 BRAF (0.45) GSK3AGSK3BKDRGAKABCG2
SCHEMBL14952388 0.92 FGFR2 (0.46) GSK3AGSK3BKDRGAKBRAF
SCHEMBL14949575 0.91 BRAF (0.43) GSK3AGSK3BKDRGAKABCG2
SCHEMBL12336445 0.90 BRAF (0.46) GSK3AGSK3BKDRGAKABCG2
SCHEMBL12336455 0.90 GSK3A (0.47) GSK3AGSK3BKDRGAKABCG2
SCHEMBL12336457 0.89 BRAF (0.43) GSK3AGSK3BKDRGAKABCG2
SCHEMBL12336272 0.89 BRAF (0.54) KDRGAKABCG2BRAFMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550266-B1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTICS SOLUTIONS INC (US) 2018-05-09 — — EP disclosed
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 — — US disclosed
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 — — US disclosed
US-9212151-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-12-15 — — US disclosed
US-9212151-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-12-15 — — US disclosed
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2015-06-11 — — US disclosed
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2015-06-11 — — US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 — — US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 — — US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 — — US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 — — US disclosed
WO-2011119894-A2 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION KINAGEN, INC (US) 2011-09-29 — — 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 (3 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-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION MAP4K2, MAP3K20, MAP3K19 GSK3A 590/4885GSK3B 581/4885KDR 533/4885
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 GSK3A 590/4885GSK3B 581/4885KDR 533/4885
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 GSK3A 590/4885GSK3B 581/4885KDR 533/4885

“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.

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